All Chemical Compounds

Sunday, January 1, 2012

All Chemical Compounds Information

Product OPENEYE NAME: 4-(3,5-dichloro-4-hydroxy-phenyl)-N-methyl-N-[[3-(trifluoromethyl)phenyl]methyl]thiazole-2-carboxamide
CAS Name: 4-(3,5-dichloro-4-hydroxyphenyl)-N-methyl-N-[[3-(trifluoromethyl)phenyl]methyl]-2-thiazolecarboxamide
IUPAC NAME: 4-(3,5-dichloro-4-hydroxyphenyl)-N-methyl-N-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole-2-carboxamide
SYSTEMATIC NAME: 4-[3,5-bis(chloranyl)-4-oxidanyl-phenyl]-N-methyl-N-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole-2-carboxamide
MOLECULAR FORMULA: C19H13Cl2F3N2O2S
MOLECULAR WEIGHT: 461.28493
SMILES: CN(CC1=CC(=CC=C1)C(F)(F)F)C(=O)C2=NC(=CS2)C3=CC(=C(C(=C3)Cl)O)Cl
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Product OPENEYE NAME: N-benzhydryl-4-(3,5-dichloro-4-hydroxy-phenyl)thiazole-2-carboxamide
CAS Name: 4-(3,5-dichloro-4-hydroxyphenyl)-N-(diphenylmethyl)-2-thiazolecarboxamide
IUPAC NAME: N-benzhydryl-4-(3,5-dichloro-4-hydroxyphenyl)-1,3-thiazole-2-carboxamide
SYSTEMATIC NAME: 4-[3,5-bis(chloranyl)-4-oxidanyl-phenyl]-N-(diphenylmethyl)-1,3-thiazole-2-carboxamide
MOLECULAR FORMULA: C23H16Cl2N2O2S
MOLECULAR WEIGHT: 455.35634
SMILES: C1=CC=C(C=C1)C(C2=CC=CC=C2)NC(=O)C3=NC(=CS3)C4=CC(=C(C(=C4)Cl)O)Cl
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Product OPENEYE NAME: S-[2-[[(2R,3R,4R,5S)-5-(2,4-diaminoimidazo[2,1-f][1,2,4]triazin-7-yl)-3,4-dihydroxy-4-methyl-tetrahydrofuran-2-yl]methoxy-[2-(2,2-dimethylpropanoylsulfanyl)ethoxy]phosphoryl]oxyethyl] 2,2-dimethylpropanethioate
CAS Name: 2,2-dimethylpropanethioic acid S-[2-[[(2R,3R,4R,5S)-5-(2,4-diamino-7-imidazo[2,1-f][1,2,4]triazinyl)-3,4-dihydroxy-4-methyl-2-oxolanyl]methoxy-[2-[(2,2-dimethyl-1-oxopropyl)thio]ethoxy]phosphoryl]oxyethyl] ester
IUPAC NAME: S-[2-[[(2R,3R,4R,5S)-5-(2,4-diaminoimidazo[2,1-f][1,2,4]triazin-7-yl)-3,4-dihydroxy-4-methyloxolan-2-yl]methoxy-[2-(2,2-dimethylpropanoylsulfanyl)ethoxy]phosphoryl]oxyethyl] 2,2-dimethylpropanethioate
SYSTEMATIC NAME: S-[2-[[(2R,3R,4R,5S)-5-[2,4-bis(azanyl)imidazo[2,1-f][1,2,4]triazin-7-yl]-4-methyl-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-[2-(2,2-dimethylpropanoylsulfanyl)ethoxy]phosphoryl]oxyethyl] 2,2-dimethylpropanethioate
MOLECULAR FORMULA: C25H41N6O9PS2
MOLECULAR WEIGHT: 664.731601
SMILES: C[C@]1([C@@H]([C@H](O[C@H]1C2=CN=C3N2N=C(N=C3N)N)COP(=O)(OCCSC(=O)C(C)(C)C)OCCSC(=O)C(C)(C)C)O)O
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Product OPENEYE NAME: ethyl (2S)-2-[[[(3R,4R,5S)-5-(4-aminoimidazo[2,1-f][1,2,4]triazin-7-yl)-3,4-dihydroxy-4-methyl-tetrahydrofuran-2-yl]methoxy-(4-chlorophenoxy)phosphoryl]amino]propanoate
CAS Name: (2S)-2-[[[(3R,4R,5S)-5-(4-amino-7-imidazo[2,1-f][1,2,4]triazinyl)-3,4-dihydroxy-4-methyl-2-oxolanyl]methoxy-(4-chlorophenoxy)phosphoryl]amino]propanoic acid ethyl ester
IUPAC NAME: ethyl (2S)-2-[[[(3R,4R,5S)-5-(4-aminoimidazo[2,1-f][1,2,4]triazin-7-yl)-3,4-dihydroxy-4-methyloxolan-2-yl]methoxy-(4-chlorophenoxy)phosphoryl]amino]propanoate
SYSTEMATIC NAME: ethyl (2S)-2-[[[(3R,4R,5S)-5-(4-azanylimidazo[2,1-f][1,2,4]triazin-7-yl)-4-methyl-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-(4-chloranylphenoxy)phosphoryl]amino]propanoate
MOLECULAR FORMULA: C22H28ClN6O8P
MOLECULAR WEIGHT: 570.919881
SMILES: CCOC(=O)[C@H](C)NP(=O)(OCC1[C@H]([C@@]([C@@H](O1)C2=CN=C3N2N=CN=C3N)(C)O)O)OC4=CC=C(C=C4)Cl
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Product OPENEYE NAME: ethyl (2S)-2-[[(4aS,6S,7S,7aS)-6-(4-aminoimidazo[2,1-f][1,2,4]triazin-7-yl)-7-hydroxy-7-methyl-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]amino]propanoate
CAS Name: (2S)-2-[[(4aS,6S,7S,7aS)-6-(4-amino-7-imidazo[2,1-f][1,2,4]triazinyl)-7-hydroxy-7-methyl-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphorin-2-yl]amino]propanoic acid ethyl ester
IUPAC NAME: ethyl (2S)-2-[[(4aS,6S,7S,7aS)-6-(4-aminoimidazo[2,1-f][1,2,4]triazin-7-yl)-7-hydroxy-7-methyl-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]amino]propanoate
SYSTEMATIC NAME: ethyl (2S)-2-[[(4aS,6S,7S,7aS)-6-(4-azanylimidazo[2,1-f][1,2,4]triazin-7-yl)-7-methyl-7-oxidanyl-2-oxidanylidene-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]amino]propanoate
MOLECULAR FORMULA: C16H23N6O7P
MOLECULAR WEIGHT: 442.363581
SMILES: CCOC(=O)[C@H](C)NP1(=O)OC[C@H]2[C@H](O1)[C@@]([C@@H](O2)C3=CN=C4N3N=CN=C4N)(C)O
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Product OPENEYE NAME: [(2R,3R,4R,5S)-5-(4-aminoimidazo[2,1-f][1,2,4]triazin-7-yl)-3,4-dihydroxy-4-methyl-tetrahydrofuran-2-yl]methyl dihydrogen phosphate
CAS Name: [(2R,3R,4R,5S)-5-(4-amino-7-imidazo[2,1-f][1,2,4]triazinyl)-3,4-dihydroxy-4-methyl-2-oxolanyl]methyl dihydrogen phosphate
IUPAC NAME: [(2R,3R,4R,5S)-5-(4-aminoimidazo[2,1-f][1,2,4]triazin-7-yl)-3,4-dihydroxy-4-methyloxolan-2-yl]methyl dihydrogen phosphate
SYSTEMATIC NAME: [(2R,3R,4R,5S)-5-(4-azanylimidazo[2,1-f][1,2,4]triazin-7-yl)-4-methyl-3,4-bis(oxidanyl)oxolan-2-yl]methyl dihydrogen phosphate
MOLECULAR FORMULA: C11H16N5O7P
MOLECULAR WEIGHT: 361.247801
SMILES: C[C@]1([C@@H]([C@H](O[C@H]1C2=CN=C3N2N=CN=C3N)COP(=O)(O)O)O)O
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Product OPENEYE NAME: [[(2R,3R,4R,5S)-5-(4-aminoimidazo[2,1-f][1,2,4]triazin-7-yl)-3,4-dihydroxy-4-methyl-tetrahydrofuran-2-yl]methoxy-(isopropoxycarbonyloxymethoxy)phosphoryl]oxymethyl isopropyl carbonate
CAS Name: carbonic acid [[(2R,3R,4R,5S)-5-(4-amino-7-imidazo[2,1-f][1,2,4]triazinyl)-3,4-dihydroxy-4-methyl-2-oxolanyl]methoxy-[[oxo(propan-2-yloxy)methoxy]methoxy]phosphoryl]oxymethyl propan-2-yl ester
IUPAC NAME: [[(2R,3R,4R,5S)-5-(4-aminoimidazo[2,1-f][1,2,4]triazin-7-yl)-3,4-dihydroxy-4-methyloxolan-2-yl]methoxy-(propan-2-yloxycarbonyloxymethoxy)phosphoryl]oxymethyl propan-2-yl carbonate
SYSTEMATIC NAME: [[(2R,3R,4R,5S)-5-(4-azanylimidazo[2,1-f][1,2,4]triazin-7-yl)-4-methyl-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-(propan-2-yloxycarbonyloxymethoxy)phosphoryl]oxymethyl propan-2-yl carbonate
MOLECULAR FORMULA: C21H32N5O13P
MOLECULAR WEIGHT: 593.478241
SMILES: CC(C)OC(=O)OCOP(=O)(OC[C@@H]1[C@H]([C@@]([C@@H](O1)C2=CN=C3N2N=CN=C3N)(C)O)O)OCOC(=O)OC(C)C
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Product OPENEYE NAME: 2-[4-[5-(4-benzylpiperidine-1-carbonyl)-1,2,4-oxadiazol-3-yl]-2,6-dibromo-phenoxy]acetic acid
CAS Name: 2-[2,6-dibromo-4-[5-[oxo-[4-(phenylmethyl)-1-piperidinyl]methyl]-1,2,4-oxadiazol-3-yl]phenoxy]acetic acid
IUPAC NAME: 2-[4-[5-(4-benzylpiperidine-1-carbonyl)-1,2,4-oxadiazol-3-yl]-2,6-dibromophenoxy]acetic acid
SYSTEMATIC NAME: 2-[2,6-bis(bromanyl)-4-[5-[4-(phenylmethyl)piperidin-1-yl]carbonyl-1,2,4-oxadiazol-3-yl]phenoxy]ethanoic acid
MOLECULAR FORMULA: C23H21Br2N3O5
MOLECULAR WEIGHT: 579.23794
SMILES: C1CN(CCC1CC2=CC=CC=C2)C(=O)C3=NC(=NO3)C4=CC(=C(C(=C4)Br)OCC(=O)O)Br
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Product OPENEYE NAME: 4-[3-(4-benzylpiperidine-1-carbonyl)-2H-1,2,4-oxadiazol-5-ylidene]-2,6-dibromo-cyclohexa-2,5-dien-1-one
CAS Name: 2,6-dibromo-4-[3-[oxo-[4-(phenylmethyl)-1-piperidinyl]methyl]-2H-1,2,4-oxadiazol-5-ylidene]-1-cyclohexa-2,5-dienone
IUPAC NAME: 4-[3-(4-benzylpiperidine-1-carbonyl)-2H-1,2,4-oxadiazol-5-ylidene]-2,6-dibromocyclohexa-2,5-dien-1-one
SYSTEMATIC NAME: 2,6-bis(bromanyl)-4-[3-[4-(phenylmethyl)piperidin-1-yl]carbonyl-2H-1,2,4-oxadiazol-5-ylidene]cyclohexa-2,5-dien-1-one
MOLECULAR FORMULA: C21H19Br2N3O3
MOLECULAR WEIGHT: 521.20186
SMILES: C1CN(CCC1CC2=CC=CC=C2)C(=O)C3=NC(=C4C=C(C(=O)C(=C4)Br)Br)ON3
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Product OPENEYE NAME: methyl 1-[2-[4-[5-(4-benzylpiperidine-1-carbonyl)-1,2,4-oxadiazol-3-yl]-2,6-dibromo-phenoxy]acetyl]piperidine-4-carboxylate
CAS Name: 1-[2-[2,6-dibromo-4-[5-[oxo-[4-(phenylmethyl)-1-piperidinyl]methyl]-1,2,4-oxadiazol-3-yl]phenoxy]-1-oxoethyl]-4-piperidinecarboxylic acid methyl ester
IUPAC NAME: methyl 1-[2-[4-[5-(4-benzylpiperidine-1-carbonyl)-1,2,4-oxadiazol-3-yl]-2,6-dibromophenoxy]acetyl]piperidine-4-carboxylate
SYSTEMATIC NAME: methyl 1-[2-[2,6-bis(bromanyl)-4-[5-[4-(phenylmethyl)piperidin-1-yl]carbonyl-1,2,4-oxadiazol-3-yl]phenoxy]ethanoyl]piperidine-4-carboxylate
MOLECULAR FORMULA: C30H32Br2N4O6
MOLECULAR WEIGHT: 704.40628
SMILES: COC(=O)C1CCN(CC1)C(=O)COC2=C(C=C(C=C2Br)C3=NOC(=N3)C(=O)N4CCC(CC4)CC5=CC=CC=C5)Br
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Product OPENEYE NAME: 2-[4-[5-(4-benzylpiperidine-1-carbonyl)-1,2,4-oxadiazol-3-yl]-2,6-dibromo-phenoxy]-N,N-bis(2-hydroxyethyl)acetamide
CAS Name: 2-[2,6-dibromo-4-[5-[oxo-[4-(phenylmethyl)-1-piperidinyl]methyl]-1,2,4-oxadiazol-3-yl]phenoxy]-N,N-bis(2-hydroxyethyl)acetamide
IUPAC NAME: 2-[4-[5-(4-benzylpiperidine-1-carbonyl)-1,2,4-oxadiazol-3-yl]-2,6-dibromophenoxy]-N,N-bis(2-hydroxyethyl)acetamide
SYSTEMATIC NAME: 2-[2,6-bis(bromanyl)-4-[5-[4-(phenylmethyl)piperidin-1-yl]carbonyl-1,2,4-oxadiazol-3-yl]phenoxy]-N,N-bis(2-hydroxyethyl)ethanamide
MOLECULAR FORMULA: C27H30Br2N4O6
MOLECULAR WEIGHT: 666.3583
SMILES: C1CN(CCC1CC2=CC=CC=C2)C(=O)C3=NC(=NO3)C4=CC(=C(C(=C4)Br)OCC(=O)N(CCO)CCO)Br
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Product OPENEYE NAME: 4-[3-(4-benzylpiperidine-1-carbonyl)-2H-1,2,4-oxadiazol-5-ylidene]-2,6-dichloro-cyclohexa-2,5-dien-1-one
CAS Name: 2,6-dichloro-4-[3-[oxo-[4-(phenylmethyl)-1-piperidinyl]methyl]-2H-1,2,4-oxadiazol-5-ylidene]-1-cyclohexa-2,5-dienone
IUPAC NAME: 4-[3-(4-benzylpiperidine-1-carbonyl)-2H-1,2,4-oxadiazol-5-ylidene]-2,6-dichlorocyclohexa-2,5-dien-1-one
SYSTEMATIC NAME: 2,6-bis(chloranyl)-4-[3-[4-(phenylmethyl)piperidin-1-yl]carbonyl-2H-1,2,4-oxadiazol-5-ylidene]cyclohexa-2,5-dien-1-one
MOLECULAR FORMULA: C21H19Cl2N3O3
MOLECULAR WEIGHT: 432.29986
SMILES: C1CN(CCC1CC2=CC=CC=C2)C(=O)C3=NC(=C4C=C(C(=O)C(=C4)Cl)Cl)ON3
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Product OPENEYE NAME: 2,6-dibromo-4-[5-[4-(2,2-dimethylpropanoyl)piperazine-1-carbonyl]-1,2,4-oxadiazol-3-ylidene]cyclohexa-2,5-dien-1-one
CAS Name: 2,6-dibromo-4-[5-[[4-(2,2-dimethyl-1-oxopropyl)-1-piperazinyl]-oxomethyl]-1,2,4-oxadiazol-3-ylidene]-1-cyclohexa-2,5-dienone
IUPAC NAME: 2,6-dibromo-4-[5-[4-(2,2-dimethylpropanoyl)piperazine-1-carbonyl]-1,2,4-oxadiazol-3-ylidene]cyclohexa-2,5-dien-1-one
SYSTEMATIC NAME: 2,6-bis(bromanyl)-4-[5-[4-(2,2-dimethylpropanoyl)piperazin-1-yl]carbonyl-1,2,4-oxadiazol-3-ylidene]cyclohexa-2,5-dien-1-one
MOLECULAR FORMULA: C18H20Br2N4O4
MOLECULAR WEIGHT: 516.1838
SMILES: CC(C)(C)C(=O)N1CCN(CC1)C(=O)C2=NC(=C3C=C(C(=O)C(=C3)Br)Br)NO2
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Product OPENEYE NAME: 2-[3-(dimethylsulfamoylamino)phenoxy]-4-fluoro-6-(2-fluoro-4-iodo-anilino)-N-[(2S)-2-hydroxypropyl]benzamide
CAS Name: 2-[3-(dimethylsulfamoylamino)phenoxy]-4-fluoro-6-(2-fluoro-4-iodoanilino)-N-[(2S)-2-hydroxypropyl]benzamide
IUPAC NAME: 2-[3-(dimethylsulfamoylamino)phenoxy]-4-fluoro-6-(2-fluoro-4-iodoanilino)-N-[(2S)-2-hydroxypropyl]benzamide
SYSTEMATIC NAME: 2-[3-(dimethylsulfamoylamino)phenoxy]-4-fluoranyl-6-[(2-fluoranyl-4-iodanyl-phenyl)amino]-N-[(2S)-2-oxidanylpropyl]benzamide
MOLECULAR FORMULA: C24H25F2IN4O5S
MOLECULAR WEIGHT: 646.445376
SMILES: C[C@@H](CNC(=O)C1=C(C=C(C=C1NC2=C(C=C(C=C2)I)F)F)OC3=CC=CC(=C3)NS(=O)(=O)N(C)C)O
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Product OPENEYE NAME: 4-fluoro-2-(2-fluoro-4-iodo-anilino)-6-[3-(methylsulfonylmethyl)phenoxy]benzamide
CAS Name: 4-fluoro-2-(2-fluoro-4-iodoanilino)-6-[3-(methylsulfonylmethyl)phenoxy]benzamide
IUPAC NAME: 4-fluoro-2-(2-fluoro-4-iodoanilino)-6-[3-(methylsulfonylmethyl)phenoxy]benzamide
SYSTEMATIC NAME: 4-fluoranyl-2-[(2-fluoranyl-4-iodanyl-phenyl)amino]-6-[3-(methylsulfonylmethyl)phenoxy]benzamide
MOLECULAR FORMULA: C21H17F2IN2O4S
MOLECULAR WEIGHT: 558.336956
SMILES: CS(=O)(=O)CC1=CC(=CC=C1)OC2=C(C(=CC(=C2)F)NC3=C(C=C(C=C3)I)F)C(=O)N
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Product OPENEYE NAME: methyl 5-[2-carbamoyl-5-fluoro-3-(2-fluoro-4-iodo-anilino)phenoxy]pyridine-3-carboxylate
CAS Name: 5-[2-carbamoyl-5-fluoro-3-(2-fluoro-4-iodoanilino)phenoxy]-3-pyridinecarboxylic acid methyl ester
IUPAC NAME: methyl 5-[2-carbamoyl-5-fluoro-3-(2-fluoro-4-iodoanilino)phenoxy]pyridine-3-carboxylate
SYSTEMATIC NAME: methyl 5-[2-aminocarbonyl-5-fluoranyl-3-[(2-fluoranyl-4-iodanyl-phenyl)amino]phenoxy]pyridine-3-carboxylate
MOLECULAR FORMULA: C20H14F2IN3O4
MOLECULAR WEIGHT: 525.244136
SMILES: COC(=O)C1=CC(=CN=C1)OC2=C(C(=CC(=C2)F)NC3=C(C=C(C=C3)I)F)C(=O)N
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All Chemical Compounds Information

Product OPENEYE NAME: 3-(diaminomethylene)-1,1-dimethyl-guanidine; 5-[[4-[(1-methylcyclohexyl)methoxy]phenyl]methyl]thiazolidine-2,4-dione
CAS Name: 3-(diaminomethylidene)-1,1-dimethylguanidine; 5-[[4-[(1-methylcyclohexyl)methoxy]phenyl]methyl]thiazolidine-2,4-dione
IUPAC NAME: 3-(diaminomethylidene)-1,1-dimethylguanidine; 5-[[4-[(1-methylcyclohexyl)methoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dione
SYSTEMATIC NAME: 3-[bis(azanyl)methylidene]-1,1-dimethyl-guanidine; 5-[[4-[(1-methylcyclohexyl)methoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dione
MOLECULAR FORMULA: C22H34N6O3S
MOLECULAR WEIGHT: 462.60876
SMILES: CC1(CCCCC1)COC2=CC=C(C=C2)CC3C(=O)NC(=O)S3.CN(C)C(=N)N=C(N)N
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Product OPENEYE NAME: 3-(diaminomethylene)-1,1-dimethyl-guanidine; 5-[[4-[3-(5-methyl-2-phenyl-oxazol-4-yl)propanoyl]phenyl]methyl]thiazolidine-2,4-dione
CAS Name: 3-(diaminomethylidene)-1,1-dimethylguanidine; 5-[[4-[3-(5-methyl-2-phenyl-4-oxazolyl)-1-oxopropyl]phenyl]methyl]thiazolidine-2,4-dione
IUPAC NAME: 3-(diaminomethylidene)-1,1-dimethylguanidine; 5-[[4-[3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)propanoyl]phenyl]methyl]-1,3-thiazolidine-2,4-dione
SYSTEMATIC NAME: 3-[bis(azanyl)methylidene]-1,1-dimethyl-guanidine; 5-[[4-[3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)propanoyl]phenyl]methyl]-1,3-thiazolidine-2,4-dione
MOLECULAR FORMULA: C27H31N7O4S
MOLECULAR WEIGHT: 549.64454
SMILES: CC1=C(N=C(O1)C2=CC=CC=C2)CCC(=O)C3=CC=C(C=C3)CC4C(=O)NC(=O)S4.CN(C)C(=N)N=C(N)N
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Product OPENEYE NAME: 5-[[(2R)-2-benzylchroman-6-yl]methyl]thiazolidine-2,4-dione; 3-(diaminomethylene)-1,1-dimethyl-guanidine
CAS Name: 3-(diaminomethylidene)-1,1-dimethylguanidine; 5-[[(2R)-2-(phenylmethyl)-3,4-dihydro-2H-1-benzopyran-6-yl]methyl]thiazolidine-2,4-dione
IUPAC NAME: 5-[[(2R)-2-benzyl-3,4-dihydro-2H-chromen-6-yl]methyl]-1,3-thiazolidine-2,4-dione; 3-(diaminomethylidene)-1,1-dimethylguanidine
SYSTEMATIC NAME: 3-[bis(azanyl)methylidene]-1,1-dimethyl-guanidine; 5-[[(2R)-2-(phenylmethyl)-3,4-dihydro-2H-chromen-6-yl]methyl]-1,3-thiazolidine-2,4-dione
MOLECULAR FORMULA: C24H30N6O3S
MOLECULAR WEIGHT: 482.5984
SMILES: CN(C)C(=N)N=C(N)N.C1CC2=C(C=CC(=C2)CC3C(=O)NC(=O)S3)O[C@H]1CC4=CC=CC=C4
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Product OPENEYE NAME: ammonium [(2S,3S,5R)-3-azido-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-2-yl]methyl bis[(4-acetoxyphenyl)methoxy]phosphoryl phosphate
CAS Name: ammonium [(2S,3S,5R)-3-azido-5-(5-methyl-2,4-dioxo-1-pyrimidinyl)-2-oxolanyl]methyl bis[(4-acetyloxyphenyl)methoxy]phosphoryl phosphate
IUPAC NAME: azanium [(2S,3S,5R)-3-azido-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl bis[(4-acetyloxyphenyl)methoxy]phosphoryl phosphate
SYSTEMATIC NAME: azanium [(2S,3S,5R)-3-azido-5-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]oxolan-2-yl]methyl bis[(4-acetyloxyphenyl)methoxy]phosphoryl phosphate
MOLECULAR FORMULA: C28H34N6O14P2
MOLECULAR WEIGHT: 740.548882
SMILES: CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)COP(=O)([O-])OP(=O)(OCC3=CC=C(C=C3)OC(=O)C)OCC4=CC=C(C=C4)OC(=O)C)N=[N+]=[N-].[NH4+]
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Product OPENEYE NAME: [4-[[(4-acetoxyphenyl)methoxy-[[(2S,3S,5R)-3-azido-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]oxy-phosphoryl]oxymethyl]phenyl] acetate
CAS Name: acetic acid [4-[[(4-acetyloxyphenyl)methoxy-[[(2S,3S,5R)-3-azido-5-(5-methyl-2,4-dioxo-1-pyrimidinyl)-2-oxolanyl]methoxy-hydroxyphosphoryl]oxyphosphoryl]oxymethyl]phenyl] ester
IUPAC NAME: [4-[[(4-acetyloxyphenyl)methoxy-[[(2S,3S,5R)-3-azido-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxyphosphoryl]oxymethyl]phenyl] acetate
SYSTEMATIC NAME: [4-[[(4-acetyloxyphenyl)methoxy-[[(2S,3S,5R)-3-azido-5-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]oxolan-2-yl]methoxy-oxidanyl-phosphoryl]oxy-phosphoryl]oxymethyl]phenyl] ethanoate
MOLECULAR FORMULA: C28H31N5O14P2
MOLECULAR WEIGHT: 723.518362
SMILES: CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)COP(=O)(O)OP(=O)(OCC3=CC=C(C=C3)OC(=O)C)OCC4=CC=C(C=C4)OC(=O)C)N=[N+]=[N-]
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Product OPENEYE NAME: zinc; 2-hydroxyundecanoate; (E)-3-(1H-imidazol-5-yl)prop-2-enoate
CAS Name: zinc; 2-hydroxyundecanoate; (E)-3-(1H-imidazol-5-yl)-2-propenoate
IUPAC NAME: zinc; 2-hydroxyundecanoate; (E)-3-(1H-imidazol-5-yl)prop-2-enoate
SYSTEMATIC NAME: zinc; (E)-3-(1H-imidazol-5-yl)prop-2-enoate; 2-oxidanylundecanoate
MOLECULAR FORMULA: C17H26N2O5Zn
MOLECULAR WEIGHT: 403.80774
SMILES: CCCCCCCCCC(C(=O)[O-])O.C1=C(NC=N1)/C=C/C(=O)[O-].[Zn+2]
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Product OPENEYE NAME: (2S)-2,5-diaminopentanoic acid; (E)-3-(1H-imidazol-5-yl)prop-2-enoic acid; selenium(4+)
CAS Name: (2S)-2,5-diaminopentanoic acid; (E)-3-(1H-imidazol-5-yl)-2-propenoic acid; selenium(4+)
IUPAC NAME: (2S)-2,5-diaminopentanoic acid; (E)-3-(1H-imidazol-5-yl)prop-2-enoic acid; selenium(4+)
SYSTEMATIC NAME: (2S)-2,5-bis(azanyl)pentanoic acid; (E)-3-(1H-imidazol-5-yl)prop-2-enoic acid; selenium(4+)
MOLECULAR FORMULA: C11H18N4O4Se+4
MOLECULAR WEIGHT: 349.24502
SMILES: C1=C(NC=N1)/C=C/C(=O)O.C(C[C@@H](C(=O)O)N)CN.[Se+4]
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Product OPENEYE NAME: (3Z)-3-imidazol-4-ylideneprop-1-ene-1,1-diolate; 2-oxidobutanoate; selenium(4+)
CAS Name: (3Z)-3-(4-imidazolylidene)-1-propene-1,1-diolate; 2-oxidobutanoate; selenium(4+)
IUPAC NAME: (3Z)-3-imidazol-4-ylideneprop-1-ene-1,1-diolate; 2-oxidobutanoate; selenium(4+)
SYSTEMATIC NAME: (3Z)-3-imidazol-4-ylideneprop-1-ene-1,1-diolate; 2-oxidanidylbutanoate; selenium(4+)
MOLECULAR FORMULA: C10H10N2O5Se
MOLECULAR WEIGHT: 317.1568
SMILES: CCC(C(=O)[O-])[O-].C\1=NC=N/C1=C\C=C([O-])[O-].[Se+4]
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Product OPENEYE NAME: (3Z)-3-imidazol-4-ylideneprop-1-ene-1,1-diolate; 2-oxidopropanoate; selenium(4+)
CAS Name: (3Z)-3-(4-imidazolylidene)-1-propene-1,1-diolate; 2-oxidopropanoate; selenium(4+)
IUPAC NAME: (3Z)-3-imidazol-4-ylideneprop-1-ene-1,1-diolate; 2-oxidopropanoate; selenium(4+)
SYSTEMATIC NAME: (3Z)-3-imidazol-4-ylideneprop-1-ene-1,1-diolate; 2-oxidanidylpropanoate; selenium(4+)
MOLECULAR FORMULA: C9H8N2O5Se
MOLECULAR WEIGHT: 303.13022
SMILES: CC(C(=O)[O-])[O-].C\1=NC=N/C1=C\C=C([O-])[O-].[Se+4]
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Product OPENEYE NAME: (2S)-2-azanidylpropanoate; (3Z)-3-imidazol-4-ylideneprop-1-ene-1,1-diolate; selenium(4+)
CAS Name: (2S)-2-azanidylpropanoate; (3Z)-3-(4-imidazolylidene)-1-propene-1,1-diolate; selenium(4+)
IUPAC NAME: (2S)-2-azanidylpropanoate; (3Z)-3-imidazol-4-ylideneprop-1-ene-1,1-diolate; selenium(4+)
SYSTEMATIC NAME: (2S)-2-azanidylpropanoate; (3Z)-3-imidazol-4-ylideneprop-1-ene-1,1-diolate; selenium(4+)
MOLECULAR FORMULA: C9H9N3O4Se
MOLECULAR WEIGHT: 302.14546
SMILES: C[C@@H](C(=O)[O-])[NH-].C\1=NC=N/C1=C\C=C([O-])[O-].[Se+4]
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Product OPENEYE NAME: 5-chloro-1-[1-(3-chlorophenyl)ethyl]-2-imino-pyridine-3-carboxamide
CAS Name: 5-chloro-1-[1-(3-chlorophenyl)ethyl]-2-imino-3-pyridinecarboxamide
IUPAC NAME: 5-chloro-1-[1-(3-chlorophenyl)ethyl]-2-iminopyridine-3-carboxamide
SYSTEMATIC NAME: 2-azanylidene-5-chloranyl-1-[1-(3-chlorophenyl)ethyl]pyridine-3-carboxamide
MOLECULAR FORMULA: C14H13Cl2N3O
MOLECULAR WEIGHT: 310.17852
SMILES: CC(C1=CC(=CC=C1)Cl)N2C=C(C=C(C2=N)C(=O)N)Cl
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Product OPENEYE NAME: 5-chloro-1-(6-chloroindan-1-yl)-2-imino-pyridine-3-carboxamide
CAS Name: 5-chloro-1-(6-chloro-2,3-dihydro-1H-inden-1-yl)-2-imino-3-pyridinecarboxamide
IUPAC NAME: 5-chloro-1-(6-chloro-2,3-dihydro-1H-inden-1-yl)-2-iminopyridine-3-carboxamide
SYSTEMATIC NAME: 2-azanylidene-5-chloranyl-1-(6-chloranyl-2,3-dihydro-1H-inden-1-yl)pyridine-3-carboxamide
MOLECULAR FORMULA: C15H13Cl2N3O
MOLECULAR WEIGHT: 322.18922
SMILES: C1CC2=C(C1N3C=C(C=C(C3=N)C(=O)N)Cl)C=C(C=C2)Cl
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Product OPENEYE NAME: 5-chloro-1-[(1R)-1-(3-fluorophenyl)ethyl]-2-imino-pyridine-3-carboxamide
CAS Name: 5-chloro-1-[(1R)-1-(3-fluorophenyl)ethyl]-2-imino-3-pyridinecarboxamide
IUPAC NAME: 5-chloro-1-[(1R)-1-(3-fluorophenyl)ethyl]-2-iminopyridine-3-carboxamide
SYSTEMATIC NAME: 2-azanylidene-5-chloranyl-1-[(1R)-1-(3-fluorophenyl)ethyl]pyridine-3-carboxamide
MOLECULAR FORMULA: C14H13ClFN3O
MOLECULAR WEIGHT: 293.723923
SMILES: C[C@H](C1=CC(=CC=C1)F)N2C=C(C=C(C2=N)C(=O)N)Cl
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Product OPENEYE NAME: 5-[[3,5-bis(trideuteriomethyl)phenoxy]methyl]-3,4,4,5-tetradeuterio-oxazolidin-2-one
CAS Name: 5-[[3,5-bis(trideuteriomethyl)phenoxy]methyl]-3,4,4,5-tetradeuterio-2-oxazolidinone
IUPAC NAME: 5-[[3,5-bis(trideuteriomethyl)phenoxy]methyl]-3,4,4,5-tetradeuterio-1,3-oxazolidin-2-one
SYSTEMATIC NAME: 5-[[3,5-bis(trideuteriomethyl)phenoxy]methyl]-3,4,4,5-tetradeuterio-1,3-oxazolidin-2-one
MOLECULAR FORMULA: C12H15NO3
MOLECULAR WEIGHT: 231.314018
SMILES: [2H]C1(C(OC(=O)N1[2H])([2H])COC2=CC(=CC(=C2)C([2H])([2H])[2H])C([2H])([2H])[2H])[2H]
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Product OPENEYE NAME: 3,4,4,5-tetradeuterio-5-[(2,4,6-trideuterio-3,5-dimethyl-phenoxy)methyl]oxazolidin-2-one
CAS Name: 3,4,4,5-tetradeuterio-5-[(2,4,6-trideuterio-3,5-dimethylphenoxy)methyl]-2-oxazolidinone
IUPAC NAME: 3,4,4,5-tetradeuterio-5-[(2,4,6-trideuterio-3,5-dimethylphenoxy)methyl]-1,3-oxazolidin-2-one
SYSTEMATIC NAME: 3,4,4,5-tetradeuterio-5-[(2,4,6-trideuterio-3,5-dimethyl-phenoxy)methyl]-1,3-oxazolidin-2-one
MOLECULAR FORMULA: C12H15NO3
MOLECULAR WEIGHT: 228.295532
SMILES: [2H]C1=C(C(=C(C(=C1C)[2H])OCC2(C(N(C(=O)O2)[2H])([2H])[2H])[2H])[2H])C
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Product OPENEYE NAME: 3,4,4,5-tetradeuterio-5-[[2,4,6-trideuterio-3,5-bis(trideuteriomethyl)phenoxy]methyl]oxazolidin-2-one
CAS Name: 3,4,4,5-tetradeuterio-5-[[2,4,6-trideuterio-3,5-bis(trideuteriomethyl)phenoxy]methyl]-2-oxazolidinone
IUPAC NAME: 3,4,4,5-tetradeuterio-5-[[2,4,6-trideuterio-3,5-bis(trideuteriomethyl)phenoxy]methyl]-1,3-oxazolidin-2-one
SYSTEMATIC NAME: 3,4,4,5-tetradeuterio-5-[[2,4,6-trideuterio-3,5-bis(trideuteriomethyl)phenoxy]methyl]-1,3-oxazolidin-2-one
MOLECULAR FORMULA: C12H15NO3
MOLECULAR WEIGHT: 234.332503
SMILES: [2H]C1=C(C(=C(C(=C1C([2H])([2H])[2H])[2H])OCC2(C(N(C(=O)O2)[2H])([2H])[2H])[2H])[2H])C([2H])([2H])[2H]
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Product OPENEYE NAME: 3,4,4,5-tetradeuterio-5-[dideuterio-(3,5-dimethylphenoxy)methyl]oxazolidin-2-one
CAS Name: 3,4,4,5-tetradeuterio-5-[dideuterio-(3,5-dimethylphenoxy)methyl]-2-oxazolidinone
IUPAC NAME: 3,4,4,5-tetradeuterio-5-[dideuterio-(3,5-dimethylphenoxy)methyl]-1,3-oxazolidin-2-one
SYSTEMATIC NAME: 3,4,4,5-tetradeuterio-5-[dideuterio-(3,5-dimethylphenoxy)methyl]-1,3-oxazolidin-2-one
MOLECULAR FORMULA: C12H15NO3
MOLECULAR WEIGHT: 227.289371
SMILES: [2H]C1(C(OC(=O)N1[2H])([2H])C([2H])([2H])OC2=CC(=CC(=C2)C)C)[2H]
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Product OPENEYE NAME: 5-[[3,5-bis(trideuteriomethyl)phenoxy]-dideuterio-methyl]-3,4,4,5-tetradeuterio-oxazolidin-2-one
CAS Name: 5-[[3,5-bis(trideuteriomethyl)phenoxy]-dideuteriomethyl]-3,4,4,5-tetradeuterio-2-oxazolidinone
IUPAC NAME: 5-[[3,5-bis(trideuteriomethyl)phenoxy]-dideuteriomethyl]-3,4,4,5-tetradeuterio-1,3-oxazolidin-2-one
SYSTEMATIC NAME: 5-[[3,5-bis(trideuteriomethyl)phenoxy]-dideuterio-methyl]-3,4,4,5-tetradeuterio-1,3-oxazolidin-2-one
MOLECULAR FORMULA: C12H15NO3
MOLECULAR WEIGHT: 233.326341
SMILES: [2H]C1(C(OC(=O)N1[2H])([2H])C([2H])([2H])OC2=CC(=CC(=C2)C([2H])([2H])[2H])C([2H])([2H])[2H])[2H]
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Product OPENEYE NAME: 3,4,4,5-tetradeuterio-5-[dideuterio-(2,4,6-trideuterio-3,5-dimethyl-phenoxy)methyl]oxazolidin-2-one
CAS Name: 3,4,4,5-tetradeuterio-5-[dideuterio-(2,4,6-trideuterio-3,5-dimethylphenoxy)methyl]-2-oxazolidinone
IUPAC NAME: 3,4,4,5-tetradeuterio-5-[dideuterio-(2,4,6-trideuterio-3,5-dimethylphenoxy)methyl]-1,3-oxazolidin-2-one
SYSTEMATIC NAME: 3,4,4,5-tetradeuterio-5-[dideuterio-(2,4,6-trideuterio-3,5-dimethyl-phenoxy)methyl]-1,3-oxazolidin-2-one
MOLECULAR FORMULA: C12H15NO3
MOLECULAR WEIGHT: 230.307856
SMILES: [2H]C1=C(C(=C(C(=C1C)[2H])OC([2H])([2H])C2(C(N(C(=O)O2)[2H])([2H])[2H])[2H])[2H])C
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Product OPENEYE NAME: 3,4,4,5-tetradeuterio-5-[dideuterio-[2,4,6-trideuterio-3,5-bis(trideuteriomethyl)phenoxy]methyl]oxazolidin-2-one
CAS Name: 3,4,4,5-tetradeuterio-5-[dideuterio-[2,4,6-trideuterio-3,5-bis(trideuteriomethyl)phenoxy]methyl]-2-oxazolidinone
IUPAC NAME: 3,4,4,5-tetradeuterio-5-[dideuterio-[2,4,6-trideuterio-3,5-bis(trideuteriomethyl)phenoxy]methyl]-1,3-oxazolidin-2-one
SYSTEMATIC NAME: 3,4,4,5-tetradeuterio-5-[dideuterio-[2,4,6-trideuterio-3,5-bis(trideuteriomethyl)phenoxy]methyl]-1,3-oxazolidin-2-one
MOLECULAR FORMULA: C12H15NO3
MOLECULAR WEIGHT: 236.344827
SMILES: [2H]C1=C(C(=C(C(=C1C([2H])([2H])[2H])[2H])OC([2H])([2H])C2(C(N(C(=O)O2)[2H])([2H])[2H])[2H])[2H])C([2H])([2H])[2H]
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Product OPENEYE NAME: N-[1-[(2S)-2-(diethoxyphosphorylmethoxy)-3-methoxy-propyl]-2-oxo-pyrimidin-4-yl]benzamide
CAS Name: N-[1-[(2S)-2-(diethoxyphosphorylmethoxy)-3-methoxypropyl]-2-oxo-4-pyrimidinyl]benzamide
IUPAC NAME: N-[1-[(2S)-2-(diethoxyphosphorylmethoxy)-3-methoxypropyl]-2-oxopyrimidin-4-yl]benzamide
SYSTEMATIC NAME: N-[1-[(2S)-2-(diethoxyphosphorylmethoxy)-3-methoxy-propyl]-2-oxidanylidene-pyrimidin-4-yl]benzamide
MOLECULAR FORMULA: C20H28N3O7P
MOLECULAR WEIGHT: 453.425981
SMILES: CCOP(=O)(CO[C@@H](CN1C=CC(=NC1=O)NC(=O)C2=CC=CC=C2)COC)OCC
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Product OPENEYE NAME: (2-amino-3-benzyloxy-3-oxo-propoxy)-(2-amino-3-benzyloxy-3-oxo-propoxy)carbonyl-phosphinic acid
CAS Name: (2-amino-3-oxo-3-phenylmethoxypropoxy)-[(2-amino-3-oxo-3-phenylmethoxypropoxy)-oxomethyl]phosphinic acid
IUPAC NAME: (2-amino-3-oxo-3-phenylmethoxypropoxy)-(2-amino-3-oxo-3-phenylmethoxypropoxy)carbonylphosphinic acid
SYSTEMATIC NAME: (2-azanyl-3-oxidanylidene-3-phenylmethoxy-propoxy)-(2-azanyl-3-oxidanylidene-3-phenylmethoxy-propoxy)carbonyl-phosphinic acid
MOLECULAR FORMULA: C21H25N2O9P
MOLECULAR WEIGHT: 480.404961
SMILES: C1=CC=C(C=C1)COC(=O)C(COC(=O)P(=O)(O)OCC(C(=O)OCC2=CC=CC=C2)N)N
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All Chemical Compounds Information

Product OPENEYE NAME: N1-[1-[(4-cyanophenyl)methyl]-4-piperidyl]-N4-[1-[[4-(trifluoromethyl)phenyl]methyl]-4-piperidyl]terephthalamide
CAS Name: N1-[1-[(4-cyanophenyl)methyl]-4-piperidinyl]-N4-[1-[[4-(trifluoromethyl)phenyl]methyl]-4-piperidinyl]benzene-1,4-dicarboxamide
IUPAC NAME: 1-N-[1-[(4-cyanophenyl)methyl]piperidin-4-yl]-4-N-[1-[[4-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]benzene-1,4-dicarboxamide
SYSTEMATIC NAME: N1-[1-[(4-cyanophenyl)methyl]piperidin-4-yl]-N4-[1-[[4-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]benzene-1,4-dicarboxamide
MOLECULAR FORMULA: C34H36F3N5O2
MOLECULAR WEIGHT: 603.67715
SMILES: C1CN(CCC1NC(=O)C2=CC=C(C=C2)C(=O)NC3CCN(CC3)CC4=CC=C(C=C4)C(F)(F)F)CC5=CC=C(C=C5)C#N
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Product OPENEYE NAME: N1-[1-[(4-cyanophenyl)methyl]-4-piperidyl]-N4-(1-phenyl-4-piperidyl)terephthalamide
CAS Name: N1-[1-[(4-cyanophenyl)methyl]-4-piperidinyl]-N4-(1-phenyl-4-piperidinyl)benzene-1,4-dicarboxamide
IUPAC NAME: 1-N-[1-[(4-cyanophenyl)methyl]piperidin-4-yl]-4-N-(1-phenylpiperidin-4-yl)benzene-1,4-dicarboxamide
SYSTEMATIC NAME: N1-[1-[(4-cyanophenyl)methyl]piperidin-4-yl]-N4-(1-phenylpiperidin-4-yl)benzene-1,4-dicarboxamide
MOLECULAR FORMULA: C32H35N5O2
MOLECULAR WEIGHT: 521.6526
SMILES: C1CN(CCC1NC(=O)C2=CC=C(C=C2)C(=O)NC3CCN(CC3)C4=CC=CC=C4)CC5=CC=C(C=C5)C#N
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Product OPENEYE NAME: N1-(1-benzyl-4-piperidyl)-N4-[1-[(4-cyanophenyl)methyl]-4-piperidyl]terephthalamide
CAS Name: N4-[1-[(4-cyanophenyl)methyl]-4-piperidinyl]-N1-[1-(phenylmethyl)-4-piperidinyl]benzene-1,4-dicarboxamide
IUPAC NAME: 1-N-(1-benzylpiperidin-4-yl)-4-N-[1-[(4-cyanophenyl)methyl]piperidin-4-yl]benzene-1,4-dicarboxamide
SYSTEMATIC NAME: N4-[1-[(4-cyanophenyl)methyl]piperidin-4-yl]-N1-[1-(phenylmethyl)piperidin-4-yl]benzene-1,4-dicarboxamide
MOLECULAR FORMULA: C33H37N5O2
MOLECULAR WEIGHT: 535.67918
SMILES: C1CN(CCC1NC(=O)C2=CC=C(C=C2)C(=O)NC3CCN(CC3)CC4=CC=C(C=C4)C#N)CC5=CC=CC=C5
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Product OPENEYE NAME: tert-butyl 2-[cyclohexylmethyl-[2-(6-methoxy-1H-indol-3-yl)-2-oxo-acetyl]amino]acetate
CAS Name: 2-[cyclohexylmethyl-[2-(6-methoxy-1H-indol-3-yl)-1,2-dioxoethyl]amino]acetic acid tert-butyl ester
IUPAC NAME: tert-butyl 2-[cyclohexylmethyl-[2-(6-methoxy-1H-indol-3-yl)-2-oxoacetyl]amino]acetate
SYSTEMATIC NAME: tert-butyl 2-[cyclohexylmethyl-[2-(6-methoxy-1H-indol-3-yl)-2-oxidanylidene-ethanoyl]amino]ethanoate
MOLECULAR FORMULA: C24H32N2O5
MOLECULAR WEIGHT: 428.52128
SMILES: CC(C)(C)OC(=O)CN(CC1CCCCC1)C(=O)C(=O)C2=CNC3=C2C=CC(=C3)OC
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Product OPENEYE NAME: ethyl 5-(3,5-difluorophenyl)sulfonyl-3-[[2-[[(1R)-2-methoxy-1-methyl-ethyl]amino]-4-(4-methylpiperazin-1-yl)benzoyl]amino]indazole-1-carboxylate
CAS Name: 5-(3,5-difluorophenyl)sulfonyl-3-[[[2-[[(2R)-1-methoxypropan-2-yl]amino]-4-(4-methyl-1-piperazinyl)phenyl]-oxomethyl]amino]-1-indazolecarboxylic acid ethyl ester
IUPAC NAME: ethyl 5-(3,5-difluorophenyl)sulfonyl-3-[[2-[[(2R)-1-methoxypropan-2-yl]amino]-4-(4-methylpiperazin-1-yl)benzoyl]amino]indazole-1-carboxylate
SYSTEMATIC NAME: ethyl 5-[3,5-bis(fluoranyl)phenyl]sulfonyl-3-[[2-[[(2R)-1-methoxypropan-2-yl]amino]-4-(4-methylpiperazin-1-yl)phenyl]carbonylamino]indazole-1-carboxylate
MOLECULAR FORMULA: C32H36F2N6O6S
MOLECULAR WEIGHT: 670.726646
SMILES: CCOC(=O)N1C2=C(C=C(C=C2)S(=O)(=O)C3=CC(=CC(=C3)F)F)C(=N1)NC(=O)C4=C(C=C(C=C4)N5CCN(CC5)C)N[C@H](C)COC
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Product OPENEYE NAME: 5-chloro-N-(2-chloro-4-nitro-phenyl)-2-hydroxy-benzamide; 2-(cyclohexanecarbonyl)-3,6,7,11b-tetrahydro-1H-pyrazino[2,1-a]isoquinolin-4-one; methyl N-(6-benzoyl-1H-benzimidazol-2-yl)carbamate
CAS Name: N-(6-benzoyl-1H-benzimidazol-2-yl)carbamic acid methyl ester; 5-chloro-N-(2-chloro-4-nitrophenyl)-2-hydroxybenzamide; 2-[cyclohexyl(oxo)methyl]-3,6,7,11b-tetrahydro-1H-pyrazino[2,1-a]isoquinolin-4-one
IUPAC NAME: 5-chloro-N-(2-chloro-4-nitrophenyl)-2-hydroxybenzamide; 2-(cyclohexanecarbonyl)-3,6,7,11b-tetrahydro-1H-pyrazino[2,1-a]isoquinolin-4-one; methyl N-(6-benzoyl-1H-benzimidazol-2-yl)carbamate
SYSTEMATIC NAME: 5-chloranyl-N-(2-chloranyl-4-nitro-phenyl)-2-oxidanyl-benzamide; 2-cyclohexylcarbonyl-3,6,7,11b-tetrahydro-1H-pyrazino[2,1-a]isoquinolin-4-one; methyl N-[6-(phenylcarbonyl)-1H-benzimidazol-2-yl]carbamate
MOLECULAR FORMULA: C48H45Cl2N7O9
MOLECULAR WEIGHT: 934.8184
SMILES: COC(=O)NC1=NC2=C(N1)C=C(C=C2)C(=O)C3=CC=CC=C3.C1CCC(CC1)C(=O)N2CC3C4=CC=CC=C4CCN3C(=O)C2.C1=CC(=C(C=C1[N+](=O)[O-])Cl)NC(=O)C2=C(C=CC(=C2)Cl)O
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Product OPENEYE NAME: 2-[4-[(4-butoxyphenyl)sulfonylamino]phenoxy]-5-(3,4-difluoroanilino)benzoic acid
CAS Name: 2-[4-[(4-butoxyphenyl)sulfonylamino]phenoxy]-5-(3,4-difluoroanilino)benzoic acid
IUPAC NAME: 2-[4-[(4-butoxyphenyl)sulfonylamino]phenoxy]-5-(3,4-difluoroanilino)benzoic acid
SYSTEMATIC NAME: 5-[[3,4-bis(fluoranyl)phenyl]amino]-2-[4-[(4-butoxyphenyl)sulfonylamino]phenoxy]benzoic acid
MOLECULAR FORMULA: C29H26F2N2O6S
MOLECULAR WEIGHT: 568.588346
SMILES: CCCCOC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)OC3=C(C=C(C=C3)NC4=CC(=C(C=C4)F)F)C(=O)O
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Product OPENEYE NAME: 4-[4-(1,1,2,2-tetrafluoroethoxy)phenoxy]piperidine hydrochloride
CAS Name: 4-[4-(1,1,2,2-tetrafluoroethoxy)phenoxy]piperidine hydrochloride
IUPAC NAME: 4-[4-(1,1,2,2-tetrafluoroethoxy)phenoxy]piperidine hydrochloride
SYSTEMATIC NAME: 4-[4-[1,1,2,2-tetrakis(fluoranyl)ethoxy]phenoxy]piperidine hydrochloride
MOLECULAR FORMULA: C13H16ClF4NO2
MOLECULAR WEIGHT: 329.718253
SMILES: C1CNCCC1OC2=CC=C(C=C2)OC(C(F)F)(F)F.Cl
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Product OPENEYE NAME: 4-[4-(1,1,2,2-tetrafluoroethoxy)phenoxy]piperidine
CAS Name: 4-[4-(1,1,2,2-tetrafluoroethoxy)phenoxy]piperidine
IUPAC NAME: 4-[4-(1,1,2,2-tetrafluoroethoxy)phenoxy]piperidine
SYSTEMATIC NAME: 4-[4-[1,1,2,2-tetrakis(fluoranyl)ethoxy]phenoxy]piperidine
MOLECULAR FORMULA: C13H15F4NO2
MOLECULAR WEIGHT: 293.257313
SMILES: C1CNCCC1OC2=CC=C(C=C2)OC(C(F)F)(F)F
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Product OPENEYE NAME: isopropyl N-[(2S)-7-cyano-4-[[(2R,3S)-3-hydroxy-1-methyl-pyrrolidin-2-yl]methyl]-2,3-dihydro-1H-cyclopenta[b]indol-2-yl]carbamate
CAS Name: N-[(2S)-7-cyano-4-[[(2R,3S)-3-hydroxy-1-methyl-2-pyrrolidinyl]methyl]-2,3-dihydro-1H-cyclopenta[b]indol-2-yl]carbamic acid propan-2-yl ester
IUPAC NAME: propan-2-yl N-[(2S)-7-cyano-4-[[(2R,3S)-3-hydroxy-1-methylpyrrolidin-2-yl]methyl]-2,3-dihydro-1H-cyclopenta[b]indol-2-yl]carbamate
SYSTEMATIC NAME: propan-2-yl N-[(2S)-7-cyano-4-[[(2R,3S)-1-methyl-3-oxidanyl-pyrrolidin-2-yl]methyl]-2,3-dihydro-1H-cyclopenta[b]indol-2-yl]carbamate
MOLECULAR FORMULA: C22H28N4O3
MOLECULAR WEIGHT: 396.48272
SMILES: CC(C)OC(=O)N[C@H]1CC2=C(C1)N(C3=C2C=C(C=C3)C#N)C[C@@H]4[C@H](CCN4C)O
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All Chemical Compounds Information

Product OPENEYE NAME: 6-cyano-1-(4-fluorophenyl)-N-[[4-(4-methylpiperazin-1-yl)sulfonylphenyl]methyl]indazole-4-carboxamide
CAS Name: 6-cyano-1-(4-fluorophenyl)-N-[[4-[(4-methyl-1-piperazinyl)sulfonyl]phenyl]methyl]-4-indazolecarboxamide
IUPAC NAME: 6-cyano-1-(4-fluorophenyl)-N-[[4-(4-methylpiperazin-1-yl)sulfonylphenyl]methyl]indazole-4-carboxamide
SYSTEMATIC NAME: 6-cyano-1-(4-fluorophenyl)-N-[[4-(4-methylpiperazin-1-yl)sulfonylphenyl]methyl]indazole-4-carboxamide
MOLECULAR FORMULA: C27H25FN6O3S
MOLECULAR WEIGHT: 532.589203
SMILES: CN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CNC(=O)C3=C4C=NN(C4=CC(=C3)C#N)C5=CC=C(C=C5)F
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Product OPENEYE NAME: 6-cyano-1-(4-fluorophenyl)-N-[[6-(methanesulfonamido)-3-pyridyl]methyl]indazole-4-carboxamide
CAS Name: 6-cyano-1-(4-fluorophenyl)-N-[[6-(methanesulfonamido)-3-pyridinyl]methyl]-4-indazolecarboxamide
IUPAC NAME: 6-cyano-1-(4-fluorophenyl)-N-[[6-(methanesulfonamido)pyridin-3-yl]methyl]indazole-4-carboxamide
SYSTEMATIC NAME: 6-cyano-1-(4-fluorophenyl)-N-[[6-(methylsulfonylamino)pyridin-3-yl]methyl]indazole-4-carboxamide
MOLECULAR FORMULA: C22H17FN6O3S
MOLECULAR WEIGHT: 464.472183
SMILES: CS(=O)(=O)NC1=NC=C(C=C1)CNC(=O)C2=C3C=NN(C3=CC(=C2)C#N)C4=CC=C(C=C4)F
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Product OPENEYE NAME: N-[[3-(dimethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide
CAS Name: N-[[3-(dimethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)-4-indazolecarboxamide
IUPAC NAME: N-[[3-(dimethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide
SYSTEMATIC NAME: N-[[3-(dimethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)indazole-4-carboxamide
MOLECULAR FORMULA: C23H21FN4O3S
MOLECULAR WEIGHT: 452.501243
SMILES: CN(C)S(=O)(=O)C1=CC=CC(=C1)CNC(=O)C2=C3C=NN(C3=CC=C2)C4=CC=C(C=C4)F
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Product OPENEYE NAME: (3R)-5'-[(E)-3-[(9R)-9-(3,5-difluorophenyl)-9-methyl-7-oxo-8,11-diazaspiro[5.5]undecan-8-yl]prop-1-enyl]spiro[1H-pyrrolo[2,3-b]pyridine-3,2'-indane]-2-one
CAS Name: (2R)-5-[(E)-3-[(9R)-9-(3,5-difluorophenyl)-9-methyl-7-oxo-8,11-diazaspiro[5.5]undecan-8-yl]prop-1-enyl]-2'-spiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]one
IUPAC NAME: (2R)-5-[(E)-3-[(9R)-9-(3,5-difluorophenyl)-9-methyl-7-oxo-8,11-diazaspiro[5.5]undecan-8-yl]prop-1-enyl]spiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-2'-one
SYSTEMATIC NAME: (2R)-5-[(E)-3-[(9R)-9-[3,5-bis(fluoranyl)phenyl]-9-methyl-7-oxidanylidene-8,11-diazaspiro[5.5]undecan-8-yl]prop-1-enyl]spiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-2'-one
MOLECULAR FORMULA: C34H34F2N4O2
MOLECULAR WEIGHT: 568.656166
SMILES: C[C@]1(CNC2(CCCCC2)C(=O)N1C/C=C/C3=CC4=C(C[C@@]5(C4)C6=C(NC5=O)N=CC=C6)C=C3)C7=CC(=CC(=C7)F)F
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Product OPENEYE NAME: (3R)-5'-[(E)-3-[(8R)-8-(3,5-difluorophenyl)-10-methyl-6-oxo-7,10-diazaspiro[4.5]decan-7-yl]prop-1-enyl]spiro[1H-pyrrolo[2,3-b]pyridine-3,2'-indane]-2-one
CAS Name: (2R)-5-[(E)-3-[(8R)-8-(3,5-difluorophenyl)-10-methyl-6-oxo-7,10-diazaspiro[4.5]decan-7-yl]prop-1-enyl]-2'-spiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]one
IUPAC NAME: (2R)-5-[(E)-3-[(8R)-8-(3,5-difluorophenyl)-10-methyl-6-oxo-7,10-diazaspiro[4.5]decan-7-yl]prop-1-enyl]spiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-2'-one
SYSTEMATIC NAME: (2R)-5-[(E)-3-[(8R)-8-[3,5-bis(fluoranyl)phenyl]-10-methyl-6-oxidanylidene-7,10-diazaspiro[4.5]decan-7-yl]prop-1-enyl]spiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-2'-one
MOLECULAR FORMULA: C33H32F2N4O2
MOLECULAR WEIGHT: 554.629586
SMILES: CN1C[C@H](N(C(=O)C12CCCC2)C/C=C/C3=CC4=C(C[C@@]5(C4)C6=C(NC5=O)N=CC=C6)C=C3)C7=CC(=CC(=C7)F)F
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Product OPENEYE NAME: (3R)-5'-[(E)-3-[(8R)-8-(4-chloro-3,5-difluoro-phenyl)-8-methyl-6-oxo-7,10-diazaspiro[4.5]decan-7-yl]prop-1-enyl]spiro[1H-pyrrolo[2,3-b]pyridine-3,2'-indane]-2-one
CAS Name: (2R)-5-[(E)-3-[(8R)-8-(4-chloro-3,5-difluorophenyl)-8-methyl-6-oxo-7,10-diazaspiro[4.5]decan-7-yl]prop-1-enyl]-2'-spiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]one
IUPAC NAME: (2R)-5-[(E)-3-[(8R)-8-(4-chloro-3,5-difluorophenyl)-8-methyl-6-oxo-7,10-diazaspiro[4.5]decan-7-yl]prop-1-enyl]spiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-2'-one
SYSTEMATIC NAME: (2R)-5-[(E)-3-[(8R)-8-[4-chloranyl-3,5-bis(fluoranyl)phenyl]-8-methyl-6-oxidanylidene-7,10-diazaspiro[4.5]decan-7-yl]prop-1-enyl]spiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-2'-one
MOLECULAR FORMULA: C33H31ClF2N4O2
MOLECULAR WEIGHT: 589.074646
SMILES: C[C@]1(CNC2(CCCC2)C(=O)N1C/C=C/C3=CC4=C(C[C@@]5(C4)C6=C(NC5=O)N=CC=C6)C=C3)C7=CC(=C(C(=C7)F)Cl)F
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Product OPENEYE NAME: (3S)-3'-[(E)-3-[(8R)-8-(3,5-difluorophenyl)-8,10-dimethyl-6-oxo-7,10-diazaspiro[4.5]decan-7-yl]prop-1-enyl]spiro[1H-pyrrolo[2,3-b]pyridine-3,6'-5,7-dihydrocyclopenta[b]pyridine]-2-one
CAS Name: (3S)-3'-[(E)-3-[(8R)-8-(3,5-difluorophenyl)-8,10-dimethyl-6-oxo-7,10-diazaspiro[4.5]decan-7-yl]prop-1-enyl]-2-spiro[1H-pyrrolo[2,3-b]pyridine-3,6'-5,7-dihydrocyclopenta[b]pyridine]one
IUPAC NAME: (3S)-3'-[(E)-3-[(8R)-8-(3,5-difluorophenyl)-8,10-dimethyl-6-oxo-7,10-diazaspiro[4.5]decan-7-yl]prop-1-enyl]spiro[1H-pyrrolo[2,3-b]pyridine-3,6'-5,7-dihydrocyclopenta[b]pyridine]-2-one
SYSTEMATIC NAME: (3S)-3'-[(E)-3-[(8R)-8-[3,5-bis(fluoranyl)phenyl]-8,10-dimethyl-6-oxidanylidene-7,10-diazaspiro[4.5]decan-7-yl]prop-1-enyl]spiro[1H-pyrrolo[2,3-b]pyridine-3,6'-5,7-dihydrocyclopenta[b]pyridine]-2-one
MOLECULAR FORMULA: C33H33F2N5O2
MOLECULAR WEIGHT: 569.644226
SMILES: C[C@]1(CN(C2(CCCC2)C(=O)N1C/C=C/C3=CC4=C(C[C@@]5(C4)C6=C(NC5=O)N=CC=C6)N=C3)C)C7=CC(=CC(=C7)F)F
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Product OPENEYE NAME: 1-(2-acetamidoethyl)-N-[(3,4-dichlorophenyl)methyl]-3-(4-methoxyphenyl)-2-oxo-quinoxaline-6-carboxamide
CAS Name: 1-(2-acetamidoethyl)-N-[(3,4-dichlorophenyl)methyl]-3-(4-methoxyphenyl)-2-oxo-6-quinoxalinecarboxamide
IUPAC NAME: 1-(2-acetamidoethyl)-N-[(3,4-dichlorophenyl)methyl]-3-(4-methoxyphenyl)-2-oxoquinoxaline-6-carboxamide
SYSTEMATIC NAME: 1-(2-acetamidoethyl)-N-[(3,4-dichlorophenyl)methyl]-3-(4-methoxyphenyl)-2-oxidanylidene-quinoxaline-6-carboxamide
MOLECULAR FORMULA: C27H24Cl2N4O4
MOLECULAR WEIGHT: 539.40986
SMILES: CC(=O)NCCN1C2=C(C=C(C=C2)C(=O)NCC3=CC(=C(C=C3)Cl)Cl)N=C(C1=O)C4=CC=C(C=C4)OC
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Product OPENEYE NAME: N-[2-[7-[(3,4-dichlorophenyl)methylamino]-2-(4-methoxyphenyl)-3-oxo-pyrido[2,3-b]pyrazin-4-yl]ethyl]acetamide
CAS Name: N-[2-[7-[(3,4-dichlorophenyl)methylamino]-2-(4-methoxyphenyl)-3-oxo-4-pyrido[2,3-b]pyrazinyl]ethyl]acetamide
IUPAC NAME: N-[2-[7-[(3,4-dichlorophenyl)methylamino]-2-(4-methoxyphenyl)-3-oxopyrido[2,3-b]pyrazin-4-yl]ethyl]acetamide
SYSTEMATIC NAME: N-[2-[7-[(3,4-dichlorophenyl)methylamino]-2-(4-methoxyphenyl)-3-oxidanylidene-pyrido[2,3-b]pyrazin-4-yl]ethyl]ethanamide
MOLECULAR FORMULA: C25H23Cl2N5O3
MOLECULAR WEIGHT: 512.38782
SMILES: CC(=O)NCCN1C2=NC=C(C=C2N=C(C1=O)C3=CC=C(C=C3)OC)NCC4=CC(=C(C=C4)Cl)Cl
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Product OPENEYE NAME: N-[2-[7-[(4-chlorophenyl)methylamino]-2-(4-methoxyphenyl)-3-oxo-pyrido[2,3-b]pyrazin-4-yl]ethyl]acetamide
CAS Name: N-[2-[7-[(4-chlorophenyl)methylamino]-2-(4-methoxyphenyl)-3-oxo-4-pyrido[2,3-b]pyrazinyl]ethyl]acetamide
IUPAC NAME: N-[2-[7-[(4-chlorophenyl)methylamino]-2-(4-methoxyphenyl)-3-oxopyrido[2,3-b]pyrazin-4-yl]ethyl]acetamide
SYSTEMATIC NAME: N-[2-[7-[(4-chlorophenyl)methylamino]-2-(4-methoxyphenyl)-3-oxidanylidene-pyrido[2,3-b]pyrazin-4-yl]ethyl]ethanamide
MOLECULAR FORMULA: C25H24ClN5O3
MOLECULAR WEIGHT: 477.94276
SMILES: CC(=O)NCCN1C2=NC=C(C=C2N=C(C1=O)C3=CC=C(C=C3)OC)NCC4=CC=C(C=C4)Cl
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Product OPENEYE NAME: N-[2-[7-[(3-chlorophenyl)methylamino]-2-(4-methoxyphenyl)-3-oxo-pyrido[2,3-b]pyrazin-4-yl]ethyl]acetamide
CAS Name: N-[2-[7-[(3-chlorophenyl)methylamino]-2-(4-methoxyphenyl)-3-oxo-4-pyrido[2,3-b]pyrazinyl]ethyl]acetamide
IUPAC NAME: N-[2-[7-[(3-chlorophenyl)methylamino]-2-(4-methoxyphenyl)-3-oxopyrido[2,3-b]pyrazin-4-yl]ethyl]acetamide
SYSTEMATIC NAME: N-[2-[7-[(3-chlorophenyl)methylamino]-2-(4-methoxyphenyl)-3-oxidanylidene-pyrido[2,3-b]pyrazin-4-yl]ethyl]ethanamide
MOLECULAR FORMULA: C25H24ClN5O3
MOLECULAR WEIGHT: 477.94276
SMILES: CC(=O)NCCN1C2=NC=C(C=C2N=C(C1=O)C3=CC=C(C=C3)OC)NCC4=CC(=CC=C4)Cl
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Product OPENEYE NAME: N-[2-[2-(4-methoxyphenyl)-7-[(4-methoxyphenyl)methylamino]-3-oxo-pyrido[2,3-b]pyrazin-4-yl]ethyl]acetamide
CAS Name: N-[2-[2-(4-methoxyphenyl)-7-[(4-methoxyphenyl)methylamino]-3-oxo-4-pyrido[2,3-b]pyrazinyl]ethyl]acetamide
IUPAC NAME: N-[2-[2-(4-methoxyphenyl)-7-[(4-methoxyphenyl)methylamino]-3-oxopyrido[2,3-b]pyrazin-4-yl]ethyl]acetamide
SYSTEMATIC NAME: N-[2-[2-(4-methoxyphenyl)-7-[(4-methoxyphenyl)methylamino]-3-oxidanylidene-pyrido[2,3-b]pyrazin-4-yl]ethyl]ethanamide
MOLECULAR FORMULA: C26H27N5O4
MOLECULAR WEIGHT: 473.52368
SMILES: CC(=O)NCCN1C2=NC=C(C=C2N=C(C1=O)C3=CC=C(C=C3)OC)NCC4=CC=C(C=C4)OC
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Product OPENEYE NAME: 2-[(4-cyanophenyl)methyl]-N-[1-[[4-(trifluoromethyl)phenyl]methyl]-4-piperidyl]-3,4-dihydro-1H-isoquinoline-7-carboxamide
CAS Name: 2-[(4-cyanophenyl)methyl]-N-[1-[[4-(trifluoromethyl)phenyl]methyl]-4-piperidinyl]-3,4-dihydro-1H-isoquinoline-7-carboxamide
IUPAC NAME: 2-[(4-cyanophenyl)methyl]-N-[1-[[4-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]-3,4-dihydro-1H-isoquinoline-7-carboxamide
SYSTEMATIC NAME: 2-[(4-cyanophenyl)methyl]-N-[1-[[4-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]-3,4-dihydro-1H-isoquinoline-7-carboxamide
MOLECULAR FORMULA: C31H31F3N4O
MOLECULAR WEIGHT: 532.59925
SMILES: C1CN(CCC1NC(=O)C2=CC3=C(CCN(C3)CC4=CC=C(C=C4)C#N)C=C2)CC5=CC=C(C=C5)C(F)(F)F
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All Chemical Compounds Information

Product OPENEYE NAME: 6-bromo-N-(3-hydroxyindan-5-yl)imidazo[2,1-b]thiazole-5-sulfonamide
CAS Name: 6-bromo-N-(3-hydroxy-2,3-dihydro-1H-inden-5-yl)-5-imidazo[2,1-b]thiazolesulfonamide
IUPAC NAME: 6-bromo-N-(3-hydroxy-2,3-dihydro-1H-inden-5-yl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
SYSTEMATIC NAME: 6-bromanyl-N-(3-oxidanyl-2,3-dihydro-1H-inden-5-yl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
MOLECULAR FORMULA: C14H12BrN3O3S2
MOLECULAR WEIGHT: 414.29738
SMILES: C1CC2=C(C1O)C=C(C=C2)NS(=O)(=O)C3=C(N=C4N3C=CS4)Br
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Product OPENEYE NAME: 6-chloro-N-(1H-indol-5-yl)imidazo[2,1-b]thiazole-5-sulfonamide
CAS Name: 6-chloro-N-(1H-indol-5-yl)-5-imidazo[2,1-b]thiazolesulfonamide
IUPAC NAME: 6-chloro-N-(1H-indol-5-yl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
SYSTEMATIC NAME: 6-chloranyl-N-(1H-indol-5-yl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
MOLECULAR FORMULA: C13H9ClN4O2S2
MOLECULAR WEIGHT: 352.81916
SMILES: C1=CC2=C(C=CN2)C=C1NS(=O)(=O)C3=C(N=C4N3C=CS4)Cl
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Product OPENEYE NAME: 6-chloro-N-(1-methylindol-5-yl)imidazo[2,1-b]thiazole-5-sulfonamide
CAS Name: 6-chloro-N-(1-methyl-5-indolyl)-5-imidazo[2,1-b]thiazolesulfonamide
IUPAC NAME: 6-chloro-N-(1-methylindol-5-yl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
SYSTEMATIC NAME: 6-chloranyl-N-(1-methylindol-5-yl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
MOLECULAR FORMULA: C14H11ClN4O2S2
MOLECULAR WEIGHT: 366.84574
SMILES: CN1C=CC2=C1C=CC(=C2)NS(=O)(=O)C3=C(N=C4N3C=CS4)Cl
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Product OPENEYE NAME: 6-chloro-N-[4-(dimethylamino)phenyl]imidazo[2,1-b]thiazole-5-sulfonamide
CAS Name: 6-chloro-N-[4-(dimethylamino)phenyl]-5-imidazo[2,1-b]thiazolesulfonamide
IUPAC NAME: 6-chloro-N-[4-(dimethylamino)phenyl]imidazo[2,1-b][1,3]thiazole-5-sulfonamide
SYSTEMATIC NAME: 6-chloranyl-N-[4-(dimethylamino)phenyl]imidazo[2,1-b][1,3]thiazole-5-sulfonamide
MOLECULAR FORMULA: C13H13ClN4O2S2
MOLECULAR WEIGHT: 356.85092
SMILES: CN(C)C1=CC=C(C=C1)NS(=O)(=O)C2=C(N=C3N2C=CS3)Cl
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Product OPENEYE NAME: N-(6-amino-5,6-dimethyl-cyclohexa-1,3-dien-1-yl)-6-chloro-imidazo[2,1-b]thiazole-5-sulfonamide
CAS Name: N-(6-amino-5,6-dimethyl-1-cyclohexa-1,3-dienyl)-6-chloro-5-imidazo[2,1-b]thiazolesulfonamide
IUPAC NAME: N-(6-amino-5,6-dimethylcyclohexa-1,3-dien-1-yl)-6-chloroimidazo[2,1-b][1,3]thiazole-5-sulfonamide
SYSTEMATIC NAME: N-(6-azanyl-5,6-dimethyl-cyclohexa-1,3-dien-1-yl)-6-chloranyl-imidazo[2,1-b][1,3]thiazole-5-sulfonamide
MOLECULAR FORMULA: C13H15ClN4O2S2
MOLECULAR WEIGHT: 358.8668
SMILES: CC1C=CC=C(C1(C)N)NS(=O)(=O)C2=C(N=C3N2C=CS3)Cl
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Product OPENEYE NAME: 6-chloro-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)imidazo[2,1-b]thiazole-5-sulfonamide
CAS Name: 6-chloro-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-5-imidazo[2,1-b]thiazolesulfonamide
IUPAC NAME: 6-chloro-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
SYSTEMATIC NAME: 6-chloranyl-N-(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
MOLECULAR FORMULA: C12H8ClN5O3S2
MOLECULAR WEIGHT: 369.80662
SMILES: C1=CC2=C(C=C1NS(=O)(=O)C3=C(N=C4N3C=CS4)Cl)NC(=O)N2
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Product OPENEYE NAME: N-(1-acetylindolin-5-yl)-6-chloro-imidazo[2,1-b]thiazole-5-sulfonamide
CAS Name: N-(1-acetyl-2,3-dihydroindol-5-yl)-6-chloro-5-imidazo[2,1-b]thiazolesulfonamide
IUPAC NAME: N-(1-acetyl-2,3-dihydroindol-5-yl)-6-chloroimidazo[2,1-b][1,3]thiazole-5-sulfonamide
SYSTEMATIC NAME: 6-chloranyl-N-(1-ethanoyl-2,3-dihydroindol-5-yl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
MOLECULAR FORMULA: C15H13ClN4O3S2
MOLECULAR WEIGHT: 396.87172
SMILES: CC(=O)N1CCC2=C1C=CC(=C2)NS(=O)(=O)C3=C(N=C4N3C=CS4)Cl
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Product OPENEYE NAME: methyl N-[5-[[3-cyano-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrazin-2-yl]amino]-2-methyl-phenyl]carbamate
CAS Name: N-[5-[[3-cyano-6-[(5-methyl-1H-pyrazol-3-yl)amino]-2-pyrazinyl]amino]-2-methylphenyl]carbamic acid methyl ester
IUPAC NAME: methyl N-[5-[[3-cyano-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrazin-2-yl]amino]-2-methylphenyl]carbamate
SYSTEMATIC NAME: methyl N-[5-[[3-cyano-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrazin-2-yl]amino]-2-methyl-phenyl]carbamate
MOLECULAR FORMULA: C18H18N8O2
MOLECULAR WEIGHT: 378.38792
SMILES: CC1=C(C=C(C=C1)NC2=NC(=CN=C2C#N)NC3=NNC(=C3)C)NC(=O)OC
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Product OPENEYE NAME: 2-chloro-N,N-dimethyl-5-[[6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrazin-2-yl]amino]benzamide
CAS Name: 2-chloro-N,N-dimethyl-5-[[6-[(5-methyl-1H-pyrazol-3-yl)amino]-2-pyrazinyl]amino]benzamide
IUPAC NAME: 2-chloro-N,N-dimethyl-5-[[6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrazin-2-yl]amino]benzamide
SYSTEMATIC NAME: 2-chloranyl-N,N-dimethyl-5-[[6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrazin-2-yl]amino]benzamide
MOLECULAR FORMULA: C17H18ClN7O
MOLECULAR WEIGHT: 371.82412
SMILES: CC1=CC(=NN1)NC2=NC(=CN=C2)NC3=CC(=C(C=C3)Cl)C(=O)N(C)C
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Product OPENEYE NAME: N-[3-[[6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrazin-2-yl]amino]phenyl]methanesulfonamide
CAS Name: N-[3-[[6-[(5-methyl-1H-pyrazol-3-yl)amino]-2-pyrazinyl]amino]phenyl]methanesulfonamide
IUPAC NAME: N-[3-[[6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrazin-2-yl]amino]phenyl]methanesulfonamide
SYSTEMATIC NAME: N-[3-[[6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrazin-2-yl]amino]phenyl]methanesulfonamide
MOLECULAR FORMULA: C15H17N7O2S
MOLECULAR WEIGHT: 359.40618
SMILES: CC1=CC(=NN1)NC2=NC(=CN=C2)NC3=CC(=CC=C3)NS(=O)(=O)C
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Product OPENEYE NAME: N-[3-[[6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrazin-2-yl]amino]phenyl]benzenesulfonamide
CAS Name: N-[3-[[6-[(5-methyl-1H-pyrazol-3-yl)amino]-2-pyrazinyl]amino]phenyl]benzenesulfonamide
IUPAC NAME: N-[3-[[6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrazin-2-yl]amino]phenyl]benzenesulfonamide
SYSTEMATIC NAME: N-[3-[[6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrazin-2-yl]amino]phenyl]benzenesulfonamide
MOLECULAR FORMULA: C20H19N7O2S
MOLECULAR WEIGHT: 421.47556
SMILES: CC1=CC(=NN1)NC2=NC(=CN=C2)NC3=CC(=CC=C3)NS(=O)(=O)C4=CC=CC=C4
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Product OPENEYE NAME: 3-[6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrazin-2-yl]benzonitrile
CAS Name: 3-[6-[(5-methyl-1H-pyrazol-3-yl)amino]-2-pyrazinyl]benzonitrile
IUPAC NAME: 3-[6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrazin-2-yl]benzonitrile
SYSTEMATIC NAME: 3-[6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrazin-2-yl]benzenecarbonitrile
MOLECULAR FORMULA: C15H12N6
MOLECULAR WEIGHT: 276.29598
SMILES: CC1=CC(=NN1)NC2=NC(=CN=C2)C3=CC=CC(=C3)C#N
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Product OPENEYE NAME: 6-(4-chlorophenyl)-N-(5-methyl-1H-pyrazol-3-yl)pyrazin-2-amine
CAS Name: 6-(4-chlorophenyl)-N-(5-methyl-1H-pyrazol-3-yl)-2-pyrazinamine
IUPAC NAME: 6-(4-chlorophenyl)-N-(5-methyl-1H-pyrazol-3-yl)pyrazin-2-amine
SYSTEMATIC NAME: 6-(4-chlorophenyl)-N-(5-methyl-1H-pyrazol-3-yl)pyrazin-2-amine
MOLECULAR FORMULA: C14H12ClN5
MOLECULAR WEIGHT: 285.73158
SMILES: CC1=CC(=NN1)NC2=NC(=CN=C2)C3=CC=C(C=C3)Cl
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Product OPENEYE NAME: 6-(4-methoxyphenyl)-N-(5-methyl-1H-pyrazol-3-yl)pyrazin-2-amine
CAS Name: 6-(4-methoxyphenyl)-N-(5-methyl-1H-pyrazol-3-yl)-2-pyrazinamine
IUPAC NAME: 6-(4-methoxyphenyl)-N-(5-methyl-1H-pyrazol-3-yl)pyrazin-2-amine
SYSTEMATIC NAME: 6-(4-methoxyphenyl)-N-(5-methyl-1H-pyrazol-3-yl)pyrazin-2-amine
MOLECULAR FORMULA: C15H15N5O
MOLECULAR WEIGHT: 281.3125
SMILES: CC1=CC(=NN1)NC2=NC(=CN=C2)C3=CC=C(C=C3)OC
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Product OPENEYE NAME:
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MOLECULAR FORMULA: C32H35FN4O5S
MOLECULAR WEIGHT: 606.707503
SMILES: CC1=CC2=C(C=C1)N=C(S2)O[C@@H]3C[C@H]4C(=O)N[C@@]5(C[C@H]5/C=C\CCCCC[C@@H](C(=O)N4C3)NC6=CC(=CC=C6)F)C(=O)O
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MOLECULAR FORMULA: C31H33FN4O6
MOLECULAR WEIGHT: 576.615323
SMILES: C1CC/C=C\[C@@H]2C[C@]2(NC(=O)[C@@H]3C[C@H](CN3C(=O)[C@H](CC1)NC4=CC(=CC=C4)F)OC5=NC6=CC=CC=C6O5)C(=O)O
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MOLECULAR FORMULA: C33H35FN4O5
MOLECULAR WEIGHT: 586.653203
SMILES: C1CC/C=C\[C@@H]2C[C@]2(NC(=O)[C@@H]3C[C@H](CN3C(=O)[C@H](CC1)NC4=CC(=CC=C4)F)OC5=NC=CC6=CC=CC=C65)C(=O)O
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MOLECULAR FORMULA: C32H36N4O6S
MOLECULAR WEIGHT: 604.71644
SMILES: COC1=CC=CC(=C1)N[C@H]2CCCCC/C=C\[C@@H]3C[C@]3(NC(=O)[C@@H]4C[C@H](CN4C2=O)OC5=NC6=CC=CC=C6S5)C(=O)O
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MOLECULAR FORMULA: C36H42FN5O6S2
MOLECULAR WEIGHT: 723.876983
SMILES: CC1(CC1)S(=O)(=O)NC(=O)[C@@]23C[C@H]2/C=C\CCCCC[C@@H](C(=O)N4C[C@@H](C[C@H]4C(=O)N3)OC5=NC6=C(S5)C=C(C=C6)F)NCC7=CC=CC=C7
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MOLECULAR FORMULA: C36H42ClN5O6S2
MOLECULAR WEIGHT: 740.33158
SMILES: CC1(CC1)S(=O)(=O)NC(=O)[C@@]23C[C@H]2/C=C\CCCCC[C@@H](C(=O)N4C[C@@H](C[C@H]4C(=O)N3)OC5=NC6=C(S5)C=C(C=C6)Cl)NCC7=CC=CC=C7
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MOLECULAR FORMULA: C37H45N5O6S2
MOLECULAR WEIGHT: 719.9131
SMILES: CC1=CC2=C(C=C1)N=C(S2)O[C@@H]3C[C@H]4C(=O)N[C@@]5(C[C@H]5/C=C\CCCCC[C@@H](C(=O)N4C3)NCC6=CC=CC=C6)C(=O)NS(=O)(=O)C7(CC7)C
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MOLECULAR FORMULA: C36H43N5O7S
MOLECULAR WEIGHT: 689.82092
SMILES: CC1(CC1)S(=O)(=O)NC(=O)[C@@]23C[C@H]2/C=C\CCCCC[C@@H](C(=O)N4C[C@@H](C[C@H]4C(=O)N3)OC5=NC6=CC=CC=C6O5)NCC7=CC=CC=C7
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Product OPENEYE NAME: 6-bromo-1-(4-fluorophenyl)-N-[(1S)-1-(6-methylsulfonyl-3-pyridyl)propyl]indazole-4-carboxamide
CAS Name: 6-bromo-1-(4-fluorophenyl)-N-[(1S)-1-(6-methylsulfonyl-3-pyridinyl)propyl]-4-indazolecarboxamide
IUPAC NAME: 6-bromo-1-(4-fluorophenyl)-N-[(1S)-1-(6-methylsulfonylpyridin-3-yl)propyl]indazole-4-carboxamide
SYSTEMATIC NAME: 6-bromanyl-1-(4-fluorophenyl)-N-[(1S)-1-(6-methylsulfonylpyridin-3-yl)propyl]indazole-4-carboxamide
MOLECULAR FORMULA: C23H20BrFN4O3S
MOLECULAR WEIGHT: 531.397303
SMILES: CC[C@@H](C1=CN=C(C=C1)S(=O)(=O)C)NC(=O)C2=CC(=CC3=C2C=NN3C4=CC=C(C=C4)F)Br
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Product OPENEYE NAME: 6-cyano-1-(4-fluorophenyl)-N-[[4-[methyl-(1-methyl-4-piperidyl)sulfamoyl]phenyl]methyl]indazole-4-carboxamide
CAS Name: 6-cyano-1-(4-fluorophenyl)-N-[[4-[methyl-(1-methyl-4-piperidinyl)sulfamoyl]phenyl]methyl]-4-indazolecarboxamide
IUPAC NAME: 6-cyano-1-(4-fluorophenyl)-N-[[4-[methyl-(1-methylpiperidin-4-yl)sulfamoyl]phenyl]methyl]indazole-4-carboxamide
SYSTEMATIC NAME: 6-cyano-1-(4-fluorophenyl)-N-[[4-[methyl-(1-methylpiperidin-4-yl)sulfamoyl]phenyl]methyl]indazole-4-carboxamide
MOLECULAR FORMULA: C29H29FN6O3S
MOLECULAR WEIGHT: 560.642363
SMILES: CN1CCC(CC1)N(C)S(=O)(=O)C2=CC=C(C=C2)CNC(=O)C3=C4C=NN(C4=CC(=C3)C#N)C5=CC=C(C=C5)F
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All Chemical Compounds Information

Product OPENEYE NAME: 2,6-ditert-butyl-N-[1-[(5-methylisoxazol-3-yl)methylcarbamoyl]cyclohexyl]pyridine-4-carboxamide
CAS Name: 2,6-ditert-butyl-N-[1-[[(5-methyl-3-isoxazolyl)methylamino]-oxomethyl]cyclohexyl]-4-pyridinecarboxamide
IUPAC NAME: 2,6-ditert-butyl-N-[1-[(5-methyl-1,2-oxazol-3-yl)methylcarbamoyl]cyclohexyl]pyridine-4-carboxamide
SYSTEMATIC NAME: 2,6-ditert-butyl-N-[1-[(5-methyl-1,2-oxazol-3-yl)methylcarbamoyl]cyclohexyl]pyridine-4-carboxamide
MOLECULAR FORMULA: C26H38N4O3
MOLECULAR WEIGHT: 454.60492
SMILES: CC1=CC(=NO1)CNC(=O)C2(CCCCC2)NC(=O)C3=CC(=NC(=C3)C(C)(C)C)C(C)(C)C
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Product OPENEYE NAME: 2,6-ditert-butyl-N-[1-(thiazol-2-ylmethylcarbamoyl)cyclohexyl]pyridine-4-carboxamide
CAS Name: 2,6-ditert-butyl-N-[1-[oxo-(2-thiazolylmethylamino)methyl]cyclohexyl]-4-pyridinecarboxamide
IUPAC NAME: 2,6-ditert-butyl-N-[1-(1,3-thiazol-2-ylmethylcarbamoyl)cyclohexyl]pyridine-4-carboxamide
SYSTEMATIC NAME: 2,6-ditert-butyl-N-[1-(1,3-thiazol-2-ylmethylcarbamoyl)cyclohexyl]pyridine-4-carboxamide
MOLECULAR FORMULA: C25H36N4O2S
MOLECULAR WEIGHT: 456.64394
SMILES: CC(C)(C)C1=CC(=CC(=N1)C(C)(C)C)C(=O)NC2(CCCCC2)C(=O)NCC3=NC=CS3
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Product OPENEYE NAME: 3,5-ditert-butyl-N-[1-[(5-methylpyrazin-2-yl)methylcarbamoyl]cyclohexyl]benzamide
CAS Name: 3,5-ditert-butyl-N-[1-[[(5-methyl-2-pyrazinyl)methylamino]-oxomethyl]cyclohexyl]benzamide
IUPAC NAME: 3,5-ditert-butyl-N-[1-[(5-methylpyrazin-2-yl)methylcarbamoyl]cyclohexyl]benzamide
SYSTEMATIC NAME: 3,5-ditert-butyl-N-[1-[(5-methylpyrazin-2-yl)methylcarbamoyl]cyclohexyl]benzamide
MOLECULAR FORMULA: C28H40N4O2
MOLECULAR WEIGHT: 464.6428
SMILES: CC1=CN=C(C=N1)CNC(=O)C2(CCCCC2)NC(=O)C3=CC(=CC(=C3)C(C)(C)C)C(C)(C)C
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Product OPENEYE NAME: ethyl 7-(2-fluoro-4-iodo-anilino)-5-oxo-2,3-dihydro-1H-indolizine-8-carboxylate
CAS Name: 7-(2-fluoro-4-iodoanilino)-5-oxo-2,3-dihydro-1H-indolizine-8-carboxylic acid ethyl ester
IUPAC NAME: ethyl 7-(2-fluoro-4-iodoanilino)-5-oxo-2,3-dihydro-1H-indolizine-8-carboxylate
SYSTEMATIC NAME: ethyl 7-[(2-fluoranyl-4-iodanyl-phenyl)amino]-5-oxidanylidene-2,3-dihydro-1H-indolizine-8-carboxylate
MOLECULAR FORMULA: C17H16FIN2O3
MOLECULAR WEIGHT: 442.223413
SMILES: CCOC(=O)C1=C2CCCN2C(=O)C=C1NC3=C(C=C(C=C3)I)F
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Product OPENEYE NAME: N-(cyclopropylmethoxy)-7-(2-fluoro-4-iodo-anilino)-5-oxo-2,3-dihydro-1H-indolizine-8-carboxamide
CAS Name: N-(cyclopropylmethoxy)-7-(2-fluoro-4-iodoanilino)-5-oxo-2,3-dihydro-1H-indolizine-8-carboxamide
IUPAC NAME: N-(cyclopropylmethoxy)-7-(2-fluoro-4-iodoanilino)-5-oxo-2,3-dihydro-1H-indolizine-8-carboxamide
SYSTEMATIC NAME: N-(cyclopropylmethoxy)-7-[(2-fluoranyl-4-iodanyl-phenyl)amino]-5-oxidanylidene-2,3-dihydro-1H-indolizine-8-carboxamide
MOLECULAR FORMULA: C19H19FIN3O3
MOLECULAR WEIGHT: 483.275333
SMILES: C1CC2=C(C(=CC(=O)N2C1)NC3=C(C=C(C=C3)I)F)C(=O)NOCC4CC4
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Product OPENEYE NAME: 7-(2-fluoro-4-iodo-anilino)-5-oxo-2,3-dihydro-1H-indolizine-8-carboxamide
CAS Name: 7-(2-fluoro-4-iodoanilino)-5-oxo-2,3-dihydro-1H-indolizine-8-carboxamide
IUPAC NAME: 7-(2-fluoro-4-iodoanilino)-5-oxo-2,3-dihydro-1H-indolizine-8-carboxamide
SYSTEMATIC NAME: 7-[(2-fluoranyl-4-iodanyl-phenyl)amino]-5-oxidanylidene-2,3-dihydro-1H-indolizine-8-carboxamide
MOLECULAR FORMULA: C15H13FIN3O2
MOLECULAR WEIGHT: 413.185493
SMILES: C1CC2=C(C(=CC(=O)N2C1)NC3=C(C=C(C=C3)I)F)C(=O)N
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Product OPENEYE NAME: 7-(4-bromo-2-fluoro-anilino)-N-ethyl-6-methyl-5-oxo-2,3-dihydro-1H-indolizine-8-carboxamide
CAS Name: 7-(4-bromo-2-fluoroanilino)-N-ethyl-6-methyl-5-oxo-2,3-dihydro-1H-indolizine-8-carboxamide
IUPAC NAME: 7-(4-bromo-2-fluoroanilino)-N-ethyl-6-methyl-5-oxo-2,3-dihydro-1H-indolizine-8-carboxamide
SYSTEMATIC NAME: 7-[(4-bromanyl-2-fluoranyl-phenyl)amino]-N-ethyl-6-methyl-5-oxidanylidene-2,3-dihydro-1H-indolizine-8-carboxamide
MOLECULAR FORMULA: C18H19BrFN3O2
MOLECULAR WEIGHT: 408.264763
SMILES: CCNC(=O)C1=C2CCCN2C(=O)C(=C1NC3=C(C=C(C=C3)Br)F)C
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Product OPENEYE NAME: 7-(4-bromo-2-fluoro-anilino)-N-(3-methoxypropyl)-6-methyl-5-oxo-2,3-dihydro-1H-indolizine-8-carboxamide
CAS Name: 7-(4-bromo-2-fluoroanilino)-N-(3-methoxypropyl)-6-methyl-5-oxo-2,3-dihydro-1H-indolizine-8-carboxamide
IUPAC NAME: 7-(4-bromo-2-fluoroanilino)-N-(3-methoxypropyl)-6-methyl-5-oxo-2,3-dihydro-1H-indolizine-8-carboxamide
SYSTEMATIC NAME: 7-[(4-bromanyl-2-fluoranyl-phenyl)amino]-N-(3-methoxypropyl)-6-methyl-5-oxidanylidene-2,3-dihydro-1H-indolizine-8-carboxamide
MOLECULAR FORMULA: C20H23BrFN3O3
MOLECULAR WEIGHT: 452.317323
SMILES: CC1=C(C(=C2CCCN2C1=O)C(=O)NCCCOC)NC3=C(C=C(C=C3)Br)F
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Product OPENEYE NAME: 7-(4-bromo-2-fluoro-anilino)-N-cyclopentyl-6-methyl-5-oxo-2,3-dihydro-1H-indolizine-8-carboxamide
CAS Name: 7-(4-bromo-2-fluoroanilino)-N-cyclopentyl-6-methyl-5-oxo-2,3-dihydro-1H-indolizine-8-carboxamide
IUPAC NAME: 7-(4-bromo-2-fluoroanilino)-N-cyclopentyl-6-methyl-5-oxo-2,3-dihydro-1H-indolizine-8-carboxamide
SYSTEMATIC NAME: 7-[(4-bromanyl-2-fluoranyl-phenyl)amino]-N-cyclopentyl-6-methyl-5-oxidanylidene-2,3-dihydro-1H-indolizine-8-carboxamide
MOLECULAR FORMULA: C21H23BrFN3O2
MOLECULAR WEIGHT: 448.328623
SMILES: CC1=C(C(=C2CCCN2C1=O)C(=O)NC3CCCC3)NC4=C(C=C(C=C4)Br)F
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Product OPENEYE NAME: 7-(2-fluoro-4-iodo-anilino)-5-oxo-2,3-dihydro-1H-indolizine-8-carboxylic acid
CAS Name: 7-(2-fluoro-4-iodoanilino)-5-oxo-2,3-dihydro-1H-indolizine-8-carboxylic acid
IUPAC NAME: 7-(2-fluoro-4-iodoanilino)-5-oxo-2,3-dihydro-1H-indolizine-8-carboxylic acid
SYSTEMATIC NAME: 7-[(2-fluoranyl-4-iodanyl-phenyl)amino]-5-oxidanylidene-2,3-dihydro-1H-indolizine-8-carboxylic acid
MOLECULAR FORMULA: C15H12FIN2O3
MOLECULAR WEIGHT: 414.170253
SMILES: C1CC2=C(C(=CC(=O)N2C1)NC3=C(C=C(C=C3)I)F)C(=O)O
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Product OPENEYE NAME: 1-[(1S,3S)-3-[3-(4-bromophenyl)pyrazol-1-yl]cyclopentyl]-4-(2-chlorophenyl)piperazine
CAS Name: 1-[(1S,3S)-3-[3-(4-bromophenyl)-1-pyrazolyl]cyclopentyl]-4-(2-chlorophenyl)piperazine
IUPAC NAME: 1-[(1S,3S)-3-[3-(4-bromophenyl)pyrazol-1-yl]cyclopentyl]-4-(2-chlorophenyl)piperazine
SYSTEMATIC NAME: 1-[(1S,3S)-3-[3-(4-bromophenyl)pyrazol-1-yl]cyclopentyl]-4-(2-chlorophenyl)piperazine
MOLECULAR FORMULA: C24H26BrClN4
MOLECULAR WEIGHT: 485.84704
SMILES: C1C[C@@H](C[C@H]1N2CCN(CC2)C3=CC=CC=C3Cl)N4C=CC(=N4)C5=CC=C(C=C5)Br
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Product OPENEYE NAME: 1-[(1S,3R)-3-[3-(4-bromophenyl)pyrazol-1-yl]cyclopentyl]-4-(2-chlorophenyl)piperazine
CAS Name: 1-[(1S,3R)-3-[3-(4-bromophenyl)-1-pyrazolyl]cyclopentyl]-4-(2-chlorophenyl)piperazine
IUPAC NAME: 1-[(1S,3R)-3-[3-(4-bromophenyl)pyrazol-1-yl]cyclopentyl]-4-(2-chlorophenyl)piperazine
SYSTEMATIC NAME: 1-[(1S,3R)-3-[3-(4-bromophenyl)pyrazol-1-yl]cyclopentyl]-4-(2-chlorophenyl)piperazine
MOLECULAR FORMULA: C24H26BrClN4
MOLECULAR WEIGHT: 485.84704
SMILES: C1C[C@H](C[C@H]1N2CCN(CC2)C3=CC=CC=C3Cl)N4C=CC(=N4)C5=CC=C(C=C5)Br
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Product OPENEYE NAME: 1-[(1S,3S)-3-[3-(4-bromophenyl)pyrazol-1-yl]cyclopentyl]-4-(3,4-dichlorophenyl)piperazine
CAS Name: 1-[(1S,3S)-3-[3-(4-bromophenyl)-1-pyrazolyl]cyclopentyl]-4-(3,4-dichlorophenyl)piperazine
IUPAC NAME: 1-[(1S,3S)-3-[3-(4-bromophenyl)pyrazol-1-yl]cyclopentyl]-4-(3,4-dichlorophenyl)piperazine
SYSTEMATIC NAME: 1-[(1S,3S)-3-[3-(4-bromophenyl)pyrazol-1-yl]cyclopentyl]-4-(3,4-dichlorophenyl)piperazine
MOLECULAR FORMULA: C24H25BrCl2N4
MOLECULAR WEIGHT: 520.2921
SMILES: C1C[C@@H](C[C@H]1N2CCN(CC2)C3=CC(=C(C=C3)Cl)Cl)N4C=CC(=N4)C5=CC=C(C=C5)Br
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Product OPENEYE NAME: 1-[(1S,3R)-3-[3-(4-bromophenyl)pyrazol-1-yl]cyclopentyl]-4-(3,4-dichlorophenyl)piperazine
CAS Name: 1-[(1S,3R)-3-[3-(4-bromophenyl)-1-pyrazolyl]cyclopentyl]-4-(3,4-dichlorophenyl)piperazine
IUPAC NAME: 1-[(1S,3R)-3-[3-(4-bromophenyl)pyrazol-1-yl]cyclopentyl]-4-(3,4-dichlorophenyl)piperazine
SYSTEMATIC NAME: 1-[(1S,3R)-3-[3-(4-bromophenyl)pyrazol-1-yl]cyclopentyl]-4-(3,4-dichlorophenyl)piperazine
MOLECULAR FORMULA: C24H25BrCl2N4
MOLECULAR WEIGHT: 520.2921
SMILES: C1C[C@H](C[C@H]1N2CCN(CC2)C3=CC(=C(C=C3)Cl)Cl)N4C=CC(=N4)C5=CC=C(C=C5)Br
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Product OPENEYE NAME: 1-(4-chlorophenyl)-4-[(1S,3R)-3-[3-(p-tolyl)pyrazol-1-yl]cyclopentyl]piperazine
CAS Name: 1-(4-chlorophenyl)-4-[(1S,3R)-3-[3-(4-methylphenyl)-1-pyrazolyl]cyclopentyl]piperazine
IUPAC NAME: 1-(4-chlorophenyl)-4-[(1S,3R)-3-[3-(4-methylphenyl)pyrazol-1-yl]cyclopentyl]piperazine
SYSTEMATIC NAME: 1-(4-chlorophenyl)-4-[(1S,3R)-3-[3-(4-methylphenyl)pyrazol-1-yl]cyclopentyl]piperazine
MOLECULAR FORMULA: C25H29ClN4
MOLECULAR WEIGHT: 420.97756
SMILES: CC1=CC=C(C=C1)C2=NN(C=C2)[C@@H]3CC[C@@H](C3)N4CCN(CC4)C5=CC=C(C=C5)Cl
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Product OPENEYE NAME: 1-(4-chlorophenyl)-4-[(1S,3S)-3-[3-(p-tolyl)pyrazol-1-yl]cyclopentyl]piperazine
CAS Name: 1-(4-chlorophenyl)-4-[(1S,3S)-3-[3-(4-methylphenyl)-1-pyrazolyl]cyclopentyl]piperazine
IUPAC NAME: 1-(4-chlorophenyl)-4-[(1S,3S)-3-[3-(4-methylphenyl)pyrazol-1-yl]cyclopentyl]piperazine
SYSTEMATIC NAME: 1-(4-chlorophenyl)-4-[(1S,3S)-3-[3-(4-methylphenyl)pyrazol-1-yl]cyclopentyl]piperazine
MOLECULAR FORMULA: C25H29ClN4
MOLECULAR WEIGHT: 420.97756
SMILES: CC1=CC=C(C=C1)C2=NN(C=C2)[C@H]3CC[C@@H](C3)N4CCN(CC4)C5=CC=C(C=C5)Cl
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All Chemical Compounds Information

Product OPENEYE NAME: N-(5-methylthiazol-2-yl)-2-(m-tolylmethylamino)acetamide
CAS Name: 2-[(3-methylphenyl)methylamino]-N-(5-methyl-2-thiazolyl)acetamide
IUPAC NAME: 2-[(3-methylphenyl)methylamino]-N-(5-methyl-1,3-thiazol-2-yl)acetamide
SYSTEMATIC NAME: 2-[(3-methylphenyl)methylamino]-N-(5-methyl-1,3-thiazol-2-yl)ethanamide
MOLECULAR FORMULA: C14H17N3OS
MOLECULAR WEIGHT: 275.36928
SMILES: CC1=CC(=CC=C1)CNCC(=O)NC2=NC=C(S2)C
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Product OPENEYE NAME: 2-[(3,4-dimethoxyphenyl)methylamino]-N-(5-methylthiazol-2-yl)acetamide
CAS Name: 2-[(3,4-dimethoxyphenyl)methylamino]-N-(5-methyl-2-thiazolyl)acetamide
IUPAC NAME: 2-[(3,4-dimethoxyphenyl)methylamino]-N-(5-methyl-1,3-thiazol-2-yl)acetamide
SYSTEMATIC NAME: 2-[(3,4-dimethoxyphenyl)methylamino]-N-(5-methyl-1,3-thiazol-2-yl)ethanamide
MOLECULAR FORMULA: C15H19N3O3S
MOLECULAR WEIGHT: 321.39466
SMILES: CC1=CN=C(S1)NC(=O)CNCC2=CC(=C(C=C2)OC)OC
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Product OPENEYE NAME: N-(5-methylthiazol-2-yl)-2-[(4-nitro-2-furyl)methylamino]acetamide
CAS Name: N-(5-methyl-2-thiazolyl)-2-[(4-nitro-2-furanyl)methylamino]acetamide
IUPAC NAME: N-(5-methyl-1,3-thiazol-2-yl)-2-[(4-nitrofuran-2-yl)methylamino]acetamide
SYSTEMATIC NAME: N-(5-methyl-1,3-thiazol-2-yl)-2-[(4-nitrofuran-2-yl)methylamino]ethanamide
MOLECULAR FORMULA: C11H12N4O4S
MOLECULAR WEIGHT: 296.30238
SMILES: CC1=CN=C(S1)NC(=O)CNCC2=CC(=CO2)[N+](=O)[O-]
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Product OPENEYE NAME: 2-[(3-chloro-2-thienyl)methylamino]-N-(5-methylthiazol-2-yl)acetamide
CAS Name: 2-[(3-chloro-2-thiophenyl)methylamino]-N-(5-methyl-2-thiazolyl)acetamide
IUPAC NAME: 2-[(3-chlorothiophen-2-yl)methylamino]-N-(5-methyl-1,3-thiazol-2-yl)acetamide
SYSTEMATIC NAME: 2-[(3-chloranylthiophen-2-yl)methylamino]-N-(5-methyl-1,3-thiazol-2-yl)ethanamide
MOLECULAR FORMULA: C11H12ClN3OS2
MOLECULAR WEIGHT: 301.81548
SMILES: CC1=CN=C(S1)NC(=O)CNCC2=C(C=CS2)Cl
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Product OPENEYE NAME: 2-(benzylamino)-N-(5-nitrothiazol-2-yl)acetamide
CAS Name: N-(5-nitro-2-thiazolyl)-2-[(phenylmethyl)amino]acetamide
IUPAC NAME: 2-(benzylamino)-N-(5-nitro-1,3-thiazol-2-yl)acetamide
SYSTEMATIC NAME: N-(5-nitro-1,3-thiazol-2-yl)-2-[(phenylmethyl)amino]ethanamide
MOLECULAR FORMULA: C12H12N4O3S
MOLECULAR WEIGHT: 292.31368
SMILES: C1=CC=C(C=C1)CNCC(=O)NC2=NC=C(S2)[N+](=O)[O-]
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Product OPENEYE NAME: 2-[(2-chlorophenyl)methylamino]-N-(5-nitrothiazol-2-yl)acetamide
CAS Name: 2-[(2-chlorophenyl)methylamino]-N-(5-nitro-2-thiazolyl)acetamide
IUPAC NAME: 2-[(2-chlorophenyl)methylamino]-N-(5-nitro-1,3-thiazol-2-yl)acetamide
SYSTEMATIC NAME: 2-[(2-chlorophenyl)methylamino]-N-(5-nitro-1,3-thiazol-2-yl)ethanamide
MOLECULAR FORMULA: C12H11ClN4O3S
MOLECULAR WEIGHT: 326.75874
SMILES: C1=CC=C(C(=C1)CNCC(=O)NC2=NC=C(S2)[N+](=O)[O-])Cl
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Product OPENEYE NAME: 2-[(4-chloro-2-cyano-3-methoxy-phenyl)methylamino]-N-(5-nitrothiazol-2-yl)acetamide
CAS Name: 2-[(4-chloro-2-cyano-3-methoxyphenyl)methylamino]-N-(5-nitro-2-thiazolyl)acetamide
IUPAC NAME: 2-[(4-chloro-2-cyano-3-methoxyphenyl)methylamino]-N-(5-nitro-1,3-thiazol-2-yl)acetamide
SYSTEMATIC NAME: 2-[(4-chloranyl-2-cyano-3-methoxy-phenyl)methylamino]-N-(5-nitro-1,3-thiazol-2-yl)ethanamide
MOLECULAR FORMULA: C14H12ClN5O4S
MOLECULAR WEIGHT: 381.79418
SMILES: COC1=C(C=CC(=C1C#N)CNCC(=O)NC2=NC=C(S2)[N+](=O)[O-])Cl
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Product OPENEYE NAME: 2-[(3-chloro-4-nitro-2-thienyl)methylamino]-N-(5-nitrothiazol-2-yl)acetamide
CAS Name: 2-[(3-chloro-4-nitro-2-thiophenyl)methylamino]-N-(5-nitro-2-thiazolyl)acetamide
IUPAC NAME: 2-[(3-chloro-4-nitrothiophen-2-yl)methylamino]-N-(5-nitro-1,3-thiazol-2-yl)acetamide
SYSTEMATIC NAME: 2-[(3-chloranyl-4-nitro-thiophen-2-yl)methylamino]-N-(5-nitro-1,3-thiazol-2-yl)ethanamide
MOLECULAR FORMULA: C10H8ClN5O5S2
MOLECULAR WEIGHT: 377.78402
SMILES: C1=C(SC(=N1)NC(=O)CNCC2=C(C(=CS2)[N+](=O)[O-])Cl)[N+](=O)[O-]
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Product OPENEYE NAME: N-[(3R)-1-[2-cyclopropyl-5-(4-fluorophenyl)thiazole-4-carbonyl]-3-piperidyl]imidazo[1,2-a]pyridine-3-carboxamide
CAS Name: N-[(3R)-1-[[2-cyclopropyl-5-(4-fluorophenyl)-4-thiazolyl]-oxomethyl]-3-piperidinyl]-3-imidazo[1,2-a]pyridinecarboxamide
IUPAC NAME: N-[(3R)-1-[2-cyclopropyl-5-(4-fluorophenyl)-1,3-thiazole-4-carbonyl]piperidin-3-yl]imidazo[1,2-a]pyridine-3-carboxamide
SYSTEMATIC NAME: N-[(3R)-1-[[2-cyclopropyl-5-(4-fluorophenyl)-1,3-thiazol-4-yl]carbonyl]piperidin-3-yl]imidazo[1,2-a]pyridine-3-carboxamide
MOLECULAR FORMULA: C26H24FN5O2S
MOLECULAR WEIGHT: 489.564463
SMILES: C1C[C@H](CN(C1)C(=O)C2=C(SC(=N2)C3CC3)C4=CC=C(C=C4)F)NC(=O)C5=CN=C6N5C=CC=C6
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Product OPENEYE NAME: N-[(3R)-1-[2-cyclopropyl-5-(4-fluorophenyl)thiazole-4-carbonyl]-3-piperidyl]-1,2-benzoxazole-3-carboxamide
CAS Name: N-[(3R)-1-[[2-cyclopropyl-5-(4-fluorophenyl)-4-thiazolyl]-oxomethyl]-3-piperidinyl]-1,2-benzoxazole-3-carboxamide
IUPAC NAME: N-[(3R)-1-[2-cyclopropyl-5-(4-fluorophenyl)-1,3-thiazole-4-carbonyl]piperidin-3-yl]-1,2-benzoxazole-3-carboxamide
SYSTEMATIC NAME: N-[(3R)-1-[[2-cyclopropyl-5-(4-fluorophenyl)-1,3-thiazol-4-yl]carbonyl]piperidin-3-yl]-1,2-benzoxazole-3-carboxamide
MOLECULAR FORMULA: C26H23FN4O3S
MOLECULAR WEIGHT: 490.549223
SMILES: C1C[C@H](CN(C1)C(=O)C2=C(SC(=N2)C3CC3)C4=CC=C(C=C4)F)NC(=O)C5=NOC6=CC=CC=C65
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Product OPENEYE NAME: N-[(3R)-1-[2-cyclopropyl-5-(4-fluorophenyl)thiazole-4-carbonyl]-3-piperidyl]-2,3-dihydro-1,4-benzodioxine-5-carboxamide
CAS Name: N-[(3R)-1-[[2-cyclopropyl-5-(4-fluorophenyl)-4-thiazolyl]-oxomethyl]-3-piperidinyl]-2,3-dihydro-1,4-benzodioxin-5-carboxamide
IUPAC NAME: N-[(3R)-1-[2-cyclopropyl-5-(4-fluorophenyl)-1,3-thiazole-4-carbonyl]piperidin-3-yl]-2,3-dihydro-1,4-benzodioxine-5-carboxamide
SYSTEMATIC NAME: N-[(3R)-1-[[2-cyclopropyl-5-(4-fluorophenyl)-1,3-thiazol-4-yl]carbonyl]piperidin-3-yl]-2,3-dihydro-1,4-benzodioxine-5-carboxamide
MOLECULAR FORMULA: C27H26FN3O4S
MOLECULAR WEIGHT: 507.576443
SMILES: C1C[C@H](CN(C1)C(=O)C2=C(SC(=N2)C3CC3)C4=CC=C(C=C4)F)NC(=O)C5=C6C(=CC=C5)OCCO6
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Product OPENEYE NAME: N-[(3R)-1-[2-cyclopropyl-5-(4-fluorophenyl)thiazole-4-carbonyl]-3-piperidyl]-1-methyl-indole-3-carboxamide
CAS Name: N-[(3R)-1-[[2-cyclopropyl-5-(4-fluorophenyl)-4-thiazolyl]-oxomethyl]-3-piperidinyl]-1-methyl-3-indolecarboxamide
IUPAC NAME: N-[(3R)-1-[2-cyclopropyl-5-(4-fluorophenyl)-1,3-thiazole-4-carbonyl]piperidin-3-yl]-1-methylindole-3-carboxamide
SYSTEMATIC NAME: N-[(3R)-1-[[2-cyclopropyl-5-(4-fluorophenyl)-1,3-thiazol-4-yl]carbonyl]piperidin-3-yl]-1-methyl-indole-3-carboxamide
MOLECULAR FORMULA: C28H27FN4O2S
MOLECULAR WEIGHT: 502.602983
SMILES: CN1C=C(C2=CC=CC=C21)C(=O)N[C@@H]3CCCN(C3)C(=O)C4=C(SC(=N4)C5CC5)C6=CC=C(C=C6)F
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Product OPENEYE NAME: N-[(3R)-1-[2-cyclopropyl-5-(4-fluorophenyl)thiazole-4-carbonyl]-3-piperidyl]isoquinoline-1-carboxamide
CAS Name: N-[(3R)-1-[[2-cyclopropyl-5-(4-fluorophenyl)-4-thiazolyl]-oxomethyl]-3-piperidinyl]-1-isoquinolinecarboxamide
IUPAC NAME: N-[(3R)-1-[2-cyclopropyl-5-(4-fluorophenyl)-1,3-thiazole-4-carbonyl]piperidin-3-yl]isoquinoline-1-carboxamide
SYSTEMATIC NAME: N-[(3R)-1-[[2-cyclopropyl-5-(4-fluorophenyl)-1,3-thiazol-4-yl]carbonyl]piperidin-3-yl]isoquinoline-1-carboxamide
MOLECULAR FORMULA: C28H25FN4O2S
MOLECULAR WEIGHT: 500.587103
SMILES: C1C[C@H](CN(C1)C(=O)C2=C(SC(=N2)C3CC3)C4=CC=C(C=C4)F)NC(=O)C5=NC=CC6=CC=CC=C65
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Product OPENEYE NAME: 2,6-ditert-butyl-N-[1-[[4-(dimethylamino)phenyl]methylcarbamoyl]cyclohexyl]pyridine-4-carboxamide
CAS Name: 2,6-ditert-butyl-N-[1-[[[4-(dimethylamino)phenyl]methylamino]-oxomethyl]cyclohexyl]-4-pyridinecarboxamide
IUPAC NAME: 2,6-ditert-butyl-N-[1-[[4-(dimethylamino)phenyl]methylcarbamoyl]cyclohexyl]pyridine-4-carboxamide
SYSTEMATIC NAME: 2,6-ditert-butyl-N-[1-[[4-(dimethylamino)phenyl]methylcarbamoyl]cyclohexyl]pyridine-4-carboxamide
MOLECULAR FORMULA: C30H44N4O2
MOLECULAR WEIGHT: 492.69596
SMILES: CC(C)(C)C1=CC(=CC(=N1)C(C)(C)C)C(=O)NC2(CCCCC2)C(=O)NCC3=CC=C(C=C3)N(C)C
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Product OPENEYE NAME: 2,6-ditert-butyl-N-[1-[(1,5-dimethylpyrazol-3-yl)methylcarbamoyl]cyclohexyl]pyridine-4-carboxamide
CAS Name: 2,6-ditert-butyl-N-[1-[[(1,5-dimethyl-3-pyrazolyl)methylamino]-oxomethyl]cyclohexyl]-4-pyridinecarboxamide
IUPAC NAME: 2,6-ditert-butyl-N-[1-[(1,5-dimethylpyrazol-3-yl)methylcarbamoyl]cyclohexyl]pyridine-4-carboxamide
SYSTEMATIC NAME: 2,6-ditert-butyl-N-[1-[(1,5-dimethylpyrazol-3-yl)methylcarbamoyl]cyclohexyl]pyridine-4-carboxamide
MOLECULAR FORMULA: C27H41N5O2
MOLECULAR WEIGHT: 467.64674
SMILES: CC1=CC(=NN1C)CNC(=O)C2(CCCCC2)NC(=O)C3=CC(=NC(=C3)C(C)(C)C)C(C)(C)C
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