All Chemical Compounds

Wednesday, October 31, 2012

All Chemical Compounds Information

Product OPENEYE NAME: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[2-(p-tolylsulfonyl)ethylsulfanyl]-1H-1,2,4-triazol-5-one
CAS Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[2-(4-methylphenyl)sulfonylethylthio]-1H-1,2,4-triazol-5-one
IUPAC NAME: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[2-(4-methylphenyl)sulfonylethylsulfanyl]-1H-1,2,4-triazol-5-one
SYSTEMATIC NAME: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[2-(4-methylphenyl)sulfonylethylsulfanyl]-1H-1,2,4-triazol-5-one
MOLECULAR FORMULA: C19H19N3O5S2
MOLECULAR WEIGHT: 433.50126
SMILES: CC1=CC=C(C=C1)S(=O)(=O)CCSC2=NNC(=O)N2C3=CC4=C(C=C3)OCCO4
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Product OPENEYE NAME: 3-[2-(2,4-dichlorophenyl)sulfonylethylsulfanyl]-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-1,2,4-triazol-5-one
CAS Name: 3-[2-(2,4-dichlorophenyl)sulfonylethylthio]-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-1,2,4-triazol-5-one
IUPAC NAME: 3-[2-(2,4-dichlorophenyl)sulfonylethylsulfanyl]-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-1,2,4-triazol-5-one
SYSTEMATIC NAME: 3-[2-(2,4-dichlorophenyl)sulfonylethylsulfanyl]-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-1,2,4-triazol-5-one
MOLECULAR FORMULA: C18H15Cl2N3O5S2
MOLECULAR WEIGHT: 488.3648
SMILES: C1COC2=C(O1)C=CC(=C2)N3C(=O)NN=C3SCCS(=O)(=O)C4=C(C=C(C=C4)Cl)Cl
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Product OPENEYE NAME: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[2-(4-fluorophenyl)sulfonylethylsulfanyl]-1H-1,2,4-triazol-5-one
CAS Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[2-(4-fluorophenyl)sulfonylethylthio]-1H-1,2,4-triazol-5-one
IUPAC NAME: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[2-(4-fluorophenyl)sulfonylethylsulfanyl]-1H-1,2,4-triazol-5-one
SYSTEMATIC NAME: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[2-(4-fluorophenyl)sulfonylethylsulfanyl]-1H-1,2,4-triazol-5-one
MOLECULAR FORMULA: C18H16FN3O5S2
MOLECULAR WEIGHT: 437.465143
SMILES: C1COC2=C(O1)C=CC(=C2)N3C(=O)NN=C3SCCS(=O)(=O)C4=CC=C(C=C4)F
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Product OPENEYE NAME: 5-(1,3-benzodioxol-5-ylmethylamino)-3,3-dimethyl-5-oxo-pentanoic acid
CAS Name: 5-(1,3-benzodioxol-5-ylmethylamino)-3,3-dimethyl-5-oxopentanoic acid
IUPAC NAME: 5-(1,3-benzodioxol-5-ylmethylamino)-3,3-dimethyl-5-oxopentanoic acid
SYSTEMATIC NAME: 5-(1,3-benzodioxol-5-ylmethylamino)-3,3-dimethyl-5-oxidanylidene-pentanoic acid
MOLECULAR FORMULA: C15H19NO5
MOLECULAR WEIGHT: 293.31506
SMILES: CC(C)(CC(=O)NCC1=CC2=C(C=C1)OCO2)CC(=O)O
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Product OPENEYE NAME: 2-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxo-ethyl]sulfanylacetic acid
CAS Name: 2-[[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl]thio]acetic acid
IUPAC NAME: 2-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl]sulfanylacetic acid
SYSTEMATIC NAME: 2-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxidanylidene-ethyl]sulfanylethanoic acid
MOLECULAR FORMULA: C12H13NO5S
MOLECULAR WEIGHT: 283.30032
SMILES: C1OC2=C(O1)C=C(C=C2)CNC(=O)CSCC(=O)O
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Product OPENEYE NAME: N-(1,3-benzodioxol-5-ylmethyl)-2-methyl-5-pyrrolidin-1-ylsulfonyl-furan-3-carboxamide
CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-methyl-5-(1-pyrrolidinylsulfonyl)-3-furancarboxamide
IUPAC NAME: N-(1,3-benzodioxol-5-ylmethyl)-2-methyl-5-pyrrolidin-1-ylsulfonylfuran-3-carboxamide
SYSTEMATIC NAME: N-(1,3-benzodioxol-5-ylmethyl)-2-methyl-5-pyrrolidin-1-ylsulfonyl-furan-3-carboxamide
MOLECULAR FORMULA: C18H20N2O6S
MOLECULAR WEIGHT: 392.4262
SMILES: CC1=C(C=C(O1)S(=O)(=O)N2CCCC2)C(=O)NCC3=CC4=C(C=C3)OCO4
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Product OPENEYE NAME: N-(1,3-benzodioxol-5-ylmethyl)-1-(4-nitrophenyl)-5-(trifluoromethyl)pyrazole-4-carboxamide
CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(4-nitrophenyl)-5-(trifluoromethyl)-4-pyrazolecarboxamide
IUPAC NAME: N-(1,3-benzodioxol-5-ylmethyl)-1-(4-nitrophenyl)-5-(trifluoromethyl)pyrazole-4-carboxamide
SYSTEMATIC NAME: N-(1,3-benzodioxol-5-ylmethyl)-1-(4-nitrophenyl)-5-(trifluoromethyl)pyrazole-4-carboxamide
MOLECULAR FORMULA: C19H13F3N4O5
MOLECULAR WEIGHT: 434.32553
SMILES: C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=C(N(N=C3)C4=CC=C(C=C4)[N+](=O)[O-])C(F)(F)F
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Product OPENEYE NAME: N-(1,3-benzodioxol-5-ylmethyl)-1-[4-(trifluoromethyl)pyrimidin-2-yl]piperidine-4-carboxamide
CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-1-[4-(trifluoromethyl)-2-pyrimidinyl]-4-piperidinecarboxamide
IUPAC NAME: N-(1,3-benzodioxol-5-ylmethyl)-1-[4-(trifluoromethyl)pyrimidin-2-yl]piperidine-4-carboxamide
SYSTEMATIC NAME: N-(1,3-benzodioxol-5-ylmethyl)-1-[4-(trifluoromethyl)pyrimidin-2-yl]piperidine-4-carboxamide
MOLECULAR FORMULA: C19H19F3N4O3
MOLECULAR WEIGHT: 408.37437
SMILES: C1CN(CCC1C(=O)NCC2=CC3=C(C=C2)OCO3)C4=NC=CC(=N4)C(F)(F)F
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Product OPENEYE NAME: 2-[2-(indan-2-ylamino)-2-oxo-ethoxy]acetic acid
CAS Name: 2-[2-(2,3-dihydro-1H-inden-2-ylamino)-2-oxoethoxy]acetic acid
IUPAC NAME: 2-[2-(2,3-dihydro-1H-inden-2-ylamino)-2-oxoethoxy]acetic acid
SYSTEMATIC NAME: 2-[2-(2,3-dihydro-1H-inden-2-ylamino)-2-oxidanylidene-ethoxy]ethanoic acid
MOLECULAR FORMULA: C13H15NO4
MOLECULAR WEIGHT: 249.2625
SMILES: C1C(CC2=CC=CC=C21)NC(=O)COCC(=O)O
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Product OPENEYE NAME: 4-(indan-2-ylamino)-4-oxo-butanoic acid
CAS Name: 4-(2,3-dihydro-1H-inden-2-ylamino)-4-oxobutanoic acid
IUPAC NAME: 4-(2,3-dihydro-1H-inden-2-ylamino)-4-oxobutanoic acid
SYSTEMATIC NAME: 4-(2,3-dihydro-1H-inden-2-ylamino)-4-oxidanylidene-butanoic acid
MOLECULAR FORMULA: C13H15NO3
MOLECULAR WEIGHT: 233.2631
SMILES: C1C(CC2=CC=CC=C21)NC(=O)CCC(=O)O
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Product OPENEYE NAME: 5-(indan-2-ylamino)-3,3-dimethyl-5-oxo-pentanoic acid
CAS Name: 5-(2,3-dihydro-1H-inden-2-ylamino)-3,3-dimethyl-5-oxopentanoic acid
IUPAC NAME: 5-(2,3-dihydro-1H-inden-2-ylamino)-3,3-dimethyl-5-oxopentanoic acid
SYSTEMATIC NAME: 5-(2,3-dihydro-1H-inden-2-ylamino)-3,3-dimethyl-5-oxidanylidene-pentanoic acid
MOLECULAR FORMULA: C16H21NO3
MOLECULAR WEIGHT: 275.34284
SMILES: CC(C)(CC(=O)NC1CC2=CC=CC=C2C1)CC(=O)O
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Product OPENEYE NAME: 2-[2-(indan-2-ylamino)-2-oxo-ethyl]sulfanylacetic acid
CAS Name: 2-[[2-(2,3-dihydro-1H-inden-2-ylamino)-2-oxoethyl]thio]acetic acid
IUPAC NAME: 2-[2-(2,3-dihydro-1H-inden-2-ylamino)-2-oxoethyl]sulfanylacetic acid
SYSTEMATIC NAME: 2-[2-(2,3-dihydro-1H-inden-2-ylamino)-2-oxidanylidene-ethyl]sulfanylethanoic acid
MOLECULAR FORMULA: C13H15NO3S
MOLECULAR WEIGHT: 265.3281
SMILES: C1C(CC2=CC=CC=C21)NC(=O)CSCC(=O)O
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Product OPENEYE NAME: 4-(indan-2-ylamino)-4-oxo-but-2-enoic acid
CAS Name: 4-(2,3-dihydro-1H-inden-2-ylamino)-4-oxo-2-butenoic acid
IUPAC NAME: 4-(2,3-dihydro-1H-inden-2-ylamino)-4-oxobut-2-enoic acid
SYSTEMATIC NAME: 4-(2,3-dihydro-1H-inden-2-ylamino)-4-oxidanylidene-but-2-enoic acid
MOLECULAR FORMULA: C13H13NO3
MOLECULAR WEIGHT: 231.24722
SMILES: C1C(CC2=CC=CC=C21)NC(=O)C=CC(=O)O
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Product OPENEYE NAME: 2-(indan-2-ylcarbamoyl)benzoic acid
CAS Name: 2-[(2,3-dihydro-1H-inden-2-ylamino)-oxomethyl]benzoic acid
IUPAC NAME: 2-(2,3-dihydro-1H-inden-2-ylcarbamoyl)benzoic acid
SYSTEMATIC NAME: 2-(2,3-dihydro-1H-inden-2-ylcarbamoyl)benzoic acid
MOLECULAR FORMULA: C17H15NO3
MOLECULAR WEIGHT: 281.3059
SMILES: C1C(CC2=CC=CC=C21)NC(=O)C3=CC=CC=C3C(=O)O
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Product OPENEYE NAME: [2-hydroxy-3-(indan-2-ylamino)propyl] 4-methylbenzenesulfonate
CAS Name: 4-methylbenzenesulfonic acid [3-(2,3-dihydro-1H-inden-2-ylamino)-2-hydroxypropyl] ester
IUPAC NAME: [3-(2,3-dihydro-1H-inden-2-ylamino)-2-hydroxypropyl] 4-methylbenzenesulfonate
SYSTEMATIC NAME: [3-(2,3-dihydro-1H-inden-2-ylamino)-2-oxidanyl-propyl] 4-methylbenzenesulfonate
MOLECULAR FORMULA: C19H23NO4S
MOLECULAR WEIGHT: 361.45522
SMILES: CC1=CC=C(C=C1)S(=O)(=O)OCC(CNC2CC3=CC=CC=C3C2)O
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Product OPENEYE NAME: [2-hydroxy-3-[4-[5-(trifluoromethyl)-2-pyridyl]piperazin-1-yl]propyl] 4-methylbenzenesulfonate
CAS Name: 4-methylbenzenesulfonic acid [2-hydroxy-3-[4-[5-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl]propyl] ester
IUPAC NAME: [2-hydroxy-3-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]propyl] 4-methylbenzenesulfonate
SYSTEMATIC NAME: [2-oxidanyl-3-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]propyl] 4-methylbenzenesulfonate
MOLECULAR FORMULA: C20H24F3N3O4S
MOLECULAR WEIGHT: 459.48247
SMILES: CC1=CC=C(C=C1)S(=O)(=O)OCC(CN2CCN(CC2)C3=NC=C(C=C3)C(F)(F)F)O
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All Chemical Compounds Information

Product OPENEYE NAME: N-(1,1-dioxothiolan-3-yl)-2,3-dihydrobenzofuran-5-sulfonamide
CAS Name: N-(1,1-dioxo-3-thiolanyl)-2,3-dihydrobenzofuran-5-sulfonamide
IUPAC NAME: N-(1,1-dioxothiolan-3-yl)-2,3-dihydro-1-benzofuran-5-sulfonamide
SYSTEMATIC NAME: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-2,3-dihydro-1-benzofuran-5-sulfonamide
MOLECULAR FORMULA: C12H15NO5S2
MOLECULAR WEIGHT: 317.3812
SMILES: C1CS(=O)(=O)CC1NS(=O)(=O)C2=CC3=C(C=C2)OCC3
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Product OPENEYE NAME: N-(1,1-dioxothiolan-3-yl)-4-fluoro-benzenesulfonamide
CAS Name: N-(1,1-dioxo-3-thiolanyl)-4-fluorobenzenesulfonamide
IUPAC NAME: N-(1,1-dioxothiolan-3-yl)-4-fluorobenzenesulfonamide
SYSTEMATIC NAME: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-4-fluoranyl-benzenesulfonamide
MOLECULAR FORMULA: C10H12FNO4S2
MOLECULAR WEIGHT: 293.334983
SMILES: C1CS(=O)(=O)CC1NS(=O)(=O)C2=CC=C(C=C2)F
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Product OPENEYE NAME: methyl 3-[(1,1-dioxothiolan-3-yl)sulfamoyl]thiophene-2-carboxylate
CAS Name: 3-[(1,1-dioxo-3-thiolanyl)sulfamoyl]-2-thiophenecarboxylic acid methyl ester
IUPAC NAME: methyl 3-[(1,1-dioxothiolan-3-yl)sulfamoyl]thiophene-2-carboxylate
SYSTEMATIC NAME: methyl 3-[[1,1-bis(oxidanylidene)thiolan-3-yl]sulfamoyl]thiophene-2-carboxylate
MOLECULAR FORMULA: C10H13NO6S3
MOLECULAR WEIGHT: 339.40832
SMILES: COC(=O)C1=C(C=CS1)S(=O)(=O)NC2CCS(=O)(=O)C2
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Product OPENEYE NAME: N-[2-chloro-4-[(1,1-dioxothiolan-3-yl)sulfamoyl]phenyl]acetamide
CAS Name: N-[2-chloro-4-[(1,1-dioxo-3-thiolanyl)sulfamoyl]phenyl]acetamide
IUPAC NAME: N-[2-chloro-4-[(1,1-dioxothiolan-3-yl)sulfamoyl]phenyl]acetamide
SYSTEMATIC NAME: N-[4-[[1,1-bis(oxidanylidene)thiolan-3-yl]sulfamoyl]-2-chloranyl-phenyl]ethanamide
MOLECULAR FORMULA: C12H15ClN2O5S2
MOLECULAR WEIGHT: 366.8409
SMILES: CC(=O)NC1=C(C=C(C=C1)S(=O)(=O)NC2CCS(=O)(=O)C2)Cl
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Product OPENEYE NAME: 4-(2-chloro-3-cyano-phenoxy)-N-(1,1-dioxothiolan-3-yl)benzenesulfonamide
CAS Name: 4-(2-chloro-3-cyanophenoxy)-N-(1,1-dioxo-3-thiolanyl)benzenesulfonamide
IUPAC NAME: 4-(2-chloro-3-cyanophenoxy)-N-(1,1-dioxothiolan-3-yl)benzenesulfonamide
SYSTEMATIC NAME: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-4-(2-chloranyl-3-cyano-phenoxy)benzenesulfonamide
MOLECULAR FORMULA: C17H15ClN2O5S2
MOLECULAR WEIGHT: 426.8944
SMILES: C1CS(=O)(=O)CC1NS(=O)(=O)C2=CC=C(C=C2)OC3=CC=CC(=C3Cl)C#N
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Product OPENEYE NAME: 4-butyl-N-(1,1-dioxothiolan-3-yl)benzenesulfonamide
CAS Name: 4-butyl-N-(1,1-dioxo-3-thiolanyl)benzenesulfonamide
IUPAC NAME: 4-butyl-N-(1,1-dioxothiolan-3-yl)benzenesulfonamide
SYSTEMATIC NAME: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-4-butyl-benzenesulfonamide
MOLECULAR FORMULA: C14H21NO4S2
MOLECULAR WEIGHT: 331.45084
SMILES: CCCCC1=CC=C(C=C1)S(=O)(=O)NC2CCS(=O)(=O)C2
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Product OPENEYE NAME: N-(1,1-dioxothiolan-3-yl)-5-(2-pyridyl)thiophene-2-sulfonamide
CAS Name: N-(1,1-dioxo-3-thiolanyl)-5-(2-pyridinyl)-2-thiophenesulfonamide
IUPAC NAME: N-(1,1-dioxothiolan-3-yl)-5-pyridin-2-ylthiophene-2-sulfonamide
SYSTEMATIC NAME: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-5-pyridin-2-yl-thiophene-2-sulfonamide
MOLECULAR FORMULA: C13H14N2O4S3
MOLECULAR WEIGHT: 358.45626
SMILES: C1CS(=O)(=O)CC1NS(=O)(=O)C2=CC=C(S2)C3=CC=CC=N3
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Product OPENEYE NAME: N-(1,1-dioxothiolan-3-yl)-1-[4-(trifluoromethyl)pyrimidin-2-yl]piperidine-4-carboxamide
CAS Name: N-(1,1-dioxo-3-thiolanyl)-1-[4-(trifluoromethyl)-2-pyrimidinyl]-4-piperidinecarboxamide
IUPAC NAME: N-(1,1-dioxothiolan-3-yl)-1-[4-(trifluoromethyl)pyrimidin-2-yl]piperidine-4-carboxamide
SYSTEMATIC NAME: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-1-[4-(trifluoromethyl)pyrimidin-2-yl]piperidine-4-carboxamide
MOLECULAR FORMULA: C15H19F3N4O3S
MOLECULAR WEIGHT: 392.39657
SMILES: C1CN(CCC1C(=O)NC2CCS(=O)(=O)C2)C3=NC=CC(=N3)C(F)(F)F
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Product OPENEYE NAME: 3-chloro-N-(1,1-dioxothiolan-3-yl)benzothiophene-2-carboxamide
CAS Name: 3-chloro-N-(1,1-dioxo-3-thiolanyl)-1-benzothiophene-2-carboxamide
IUPAC NAME: 3-chloro-N-(1,1-dioxothiolan-3-yl)-1-benzothiophene-2-carboxamide
SYSTEMATIC NAME: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-3-chloranyl-1-benzothiophene-2-carboxamide
MOLECULAR FORMULA: C13H12ClNO3S2
MOLECULAR WEIGHT: 329.82228
SMILES: C1CS(=O)(=O)CC1NC(=O)C2=C(C3=CC=CC=C3S2)Cl
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Product OPENEYE NAME: N-(1,1-dioxothiolan-3-yl)-5-methyl-2-phenyl-triazole-4-carboxamide
CAS Name: N-(1,1-dioxo-3-thiolanyl)-5-methyl-2-phenyl-4-triazolecarboxamide
IUPAC NAME: N-(1,1-dioxothiolan-3-yl)-5-methyl-2-phenyltriazole-4-carboxamide
SYSTEMATIC NAME: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-5-methyl-2-phenyl-1,2,3-triazole-4-carboxamide
MOLECULAR FORMULA: C14H16N4O3S
MOLECULAR WEIGHT: 320.36684
SMILES: CC1=NN(N=C1C(=O)NC2CCS(=O)(=O)C2)C3=CC=CC=C3
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Product OPENEYE NAME: N-(1,1-dioxothiolan-3-yl)-5-methyl-3-phenyl-isoxazole-4-carboxamide
CAS Name: N-(1,1-dioxo-3-thiolanyl)-5-methyl-3-phenyl-4-isoxazolecarboxamide
IUPAC NAME: N-(1,1-dioxothiolan-3-yl)-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide
SYSTEMATIC NAME: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide
MOLECULAR FORMULA: C15H16N2O4S
MOLECULAR WEIGHT: 320.36354
SMILES: CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)NC3CCS(=O)(=O)C3
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Product OPENEYE NAME: 3-[2-(2,4-dichlorophenyl)sulfonylethylsulfanyl]-5-(2-furyl)-4-methyl-1,2,4-triazole
CAS Name: 3-[2-(2,4-dichlorophenyl)sulfonylethylthio]-5-(2-furanyl)-4-methyl-1,2,4-triazole
IUPAC NAME: 3-[2-(2,4-dichlorophenyl)sulfonylethylsulfanyl]-5-(furan-2-yl)-4-methyl-1,2,4-triazole
SYSTEMATIC NAME: 3-[2-(2,4-dichlorophenyl)sulfonylethylsulfanyl]-5-(furan-2-yl)-4-methyl-1,2,4-triazole
MOLECULAR FORMULA: C15H13Cl2N3O3S2
MOLECULAR WEIGHT: 418.31802
SMILES: CN1C(=NN=C1SCCS(=O)(=O)C2=C(C=C(C=C2)Cl)Cl)C3=CC=CO3
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Product OPENEYE NAME: 3-(2-furyl)-4-methyl-5-[2-(p-tolylsulfonyl)ethylsulfanyl]-1,2,4-triazole
CAS Name: 3-(2-furanyl)-4-methyl-5-[2-(4-methylphenyl)sulfonylethylthio]-1,2,4-triazole
IUPAC NAME: 3-(furan-2-yl)-4-methyl-5-[2-(4-methylphenyl)sulfonylethylsulfanyl]-1,2,4-triazole
SYSTEMATIC NAME: 3-(furan-2-yl)-4-methyl-5-[2-(4-methylphenyl)sulfonylethylsulfanyl]-1,2,4-triazole
MOLECULAR FORMULA: C16H17N3O3S2
MOLECULAR WEIGHT: 363.45448
SMILES: CC1=CC=C(C=C1)S(=O)(=O)CCSC2=NN=C(N2C)C3=CC=CO3
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Product OPENEYE NAME: 1-(4,5-dichloro-2-thienyl)-2-[[5-(2-furyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]ethanone
CAS Name: 1-(4,5-dichloro-2-thiophenyl)-2-[[5-(2-furanyl)-4-methyl-1,2,4-triazol-3-yl]thio]ethanone
IUPAC NAME: 1-(4,5-dichlorothiophen-2-yl)-2-[[5-(furan-2-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]ethanone
SYSTEMATIC NAME: 1-[4,5-bis(chloranyl)thiophen-2-yl]-2-[[5-(furan-2-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]ethanone
MOLECULAR FORMULA: C13H9Cl2N3O2S2
MOLECULAR WEIGHT: 374.26546
SMILES: CN1C(=NN=C1SCC(=O)C2=CC(=C(S2)Cl)Cl)C3=CC=CO3
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Product OPENEYE NAME: 2-[[5-(2-furyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-[4-(trifluoromethoxy)phenyl]acetamide
CAS Name: 2-[[5-(2-furanyl)-4-methyl-1,2,4-triazol-3-yl]thio]-N-[4-(trifluoromethoxy)phenyl]acetamide
IUPAC NAME: 2-[[5-(furan-2-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-[4-(trifluoromethoxy)phenyl]acetamide
SYSTEMATIC NAME: 2-[[5-(furan-2-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-[4-(trifluoromethyloxy)phenyl]ethanamide
MOLECULAR FORMULA: C16H13F3N4O3S
MOLECULAR WEIGHT: 398.35963
SMILES: CN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)OC(F)(F)F)C3=CC=CO3
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Product OPENEYE NAME: 4-(4-fluorophenyl)-3-(2-methoxyphenyl)oxazol-2-one
CAS Name: 4-(4-fluorophenyl)-3-(2-methoxyphenyl)-2-oxazolone
IUPAC NAME: 4-(4-fluorophenyl)-3-(2-methoxyphenyl)-1,3-oxazol-2-one
SYSTEMATIC NAME: 4-(4-fluorophenyl)-3-(2-methoxyphenyl)-1,3-oxazol-2-one
MOLECULAR FORMULA: C16H12FNO3
MOLECULAR WEIGHT: 285.269783
SMILES: COC1=CC=CC=C1N2C(=COC2=O)C3=CC=C(C=C3)F
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Product OPENEYE NAME: 3-(4-butylphenyl)-4-(4-fluorophenyl)oxazol-2-one
CAS Name: 3-(4-butylphenyl)-4-(4-fluorophenyl)-2-oxazolone
IUPAC NAME: 3-(4-butylphenyl)-4-(4-fluorophenyl)-1,3-oxazol-2-one
SYSTEMATIC NAME: 3-(4-butylphenyl)-4-(4-fluorophenyl)-1,3-oxazol-2-one
MOLECULAR FORMULA: C19H18FNO2
MOLECULAR WEIGHT: 311.350123
SMILES: CCCCC1=CC=C(C=C1)N2C(=COC2=O)C3=CC=C(C=C3)F
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Product OPENEYE NAME: 4-(4-benzyloxyphenyl)-3-[2-(p-tolylsulfonyl)ethylsulfanyl]-1H-1,2,4-triazol-5-one
CAS Name: 3-[2-(4-methylphenyl)sulfonylethylthio]-4-(4-phenylmethoxyphenyl)-1H-1,2,4-triazol-5-one
IUPAC NAME: 3-[2-(4-methylphenyl)sulfonylethylsulfanyl]-4-(4-phenylmethoxyphenyl)-1H-1,2,4-triazol-5-one
SYSTEMATIC NAME: 3-[2-(4-methylphenyl)sulfonylethylsulfanyl]-4-(4-phenylmethoxyphenyl)-1H-1,2,4-triazol-5-one
MOLECULAR FORMULA: C24H23N3O4S2
MOLECULAR WEIGHT: 481.58712
SMILES: CC1=CC=C(C=C1)S(=O)(=O)CCSC2=NNC(=O)N2C3=CC=C(C=C3)OCC4=CC=CC=C4
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Product OPENEYE NAME: 4-(4-benzyloxyphenyl)-3-[2-(2,4-dichlorophenyl)sulfonylethylsulfanyl]-1H-1,2,4-triazol-5-one
CAS Name: 3-[2-(2,4-dichlorophenyl)sulfonylethylthio]-4-(4-phenylmethoxyphenyl)-1H-1,2,4-triazol-5-one
IUPAC NAME: 3-[2-(2,4-dichlorophenyl)sulfonylethylsulfanyl]-4-(4-phenylmethoxyphenyl)-1H-1,2,4-triazol-5-one
SYSTEMATIC NAME: 3-[2-(2,4-dichlorophenyl)sulfonylethylsulfanyl]-4-(4-phenylmethoxyphenyl)-1H-1,2,4-triazol-5-one
MOLECULAR FORMULA: C23H19Cl2N3O4S2
MOLECULAR WEIGHT: 536.45066
SMILES: C1=CC=C(C=C1)COC2=CC=C(C=C2)N3C(=O)NN=C3SCCS(=O)(=O)C4=C(C=C(C=C4)Cl)Cl
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Product OPENEYE NAME: 4-(4-benzyloxyphenyl)-3-[2-[3-(trifluoromethyl)phenyl]sulfonylethylsulfanyl]-1H-1,2,4-triazol-5-one
CAS Name: 4-(4-phenylmethoxyphenyl)-3-[2-[3-(trifluoromethyl)phenyl]sulfonylethylthio]-1H-1,2,4-triazol-5-one
IUPAC NAME: 4-(4-phenylmethoxyphenyl)-3-[2-[3-(trifluoromethyl)phenyl]sulfonylethylsulfanyl]-1H-1,2,4-triazol-5-one
SYSTEMATIC NAME: 4-(4-phenylmethoxyphenyl)-3-[2-[3-(trifluoromethyl)phenyl]sulfonylethylsulfanyl]-1H-1,2,4-triazol-5-one
MOLECULAR FORMULA: C24H20F3N3O4S2
MOLECULAR WEIGHT: 535.55851
SMILES: C1=CC=C(C=C1)COC2=CC=C(C=C2)N3C(=O)NN=C3SCCS(=O)(=O)C4=CC=CC(=C4)C(F)(F)F
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All Chemical Compounds Information

Product OPENEYE NAME: N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-2-(2-fluorophenyl)acetamide
CAS Name: N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-2-(2-fluorophenyl)acetamide
IUPAC NAME: N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-2-(2-fluorophenyl)acetamide
SYSTEMATIC NAME: N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-2-(2-fluorophenyl)ethanamide
MOLECULAR FORMULA: C13H12FN3OS
MOLECULAR WEIGHT: 277.317283
SMILES: C1CC1C2=NN=C(S2)NC(=O)CC3=CC=CC=C3F
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Product OPENEYE NAME: N'-(2,5-dichlorophenyl)-2,4-difluoro-benzohydrazide
CAS Name: N'-(2,5-dichlorophenyl)-2,4-difluorobenzohydrazide
IUPAC NAME: N'-(2,5-dichlorophenyl)-2,4-difluorobenzohydrazide
SYSTEMATIC NAME: N'-[2,5-bis(chloranyl)phenyl]-2,4-bis(fluoranyl)benzohydrazide
MOLECULAR FORMULA: C13H8Cl2F2N2O
MOLECULAR WEIGHT: 317.118226
SMILES: C1=CC(=C(C=C1F)F)C(=O)NNC2=C(C=CC(=C2)Cl)Cl
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Product OPENEYE NAME: 4-chloro-N-[2-chloro-4-(trifluoromethyl)phenyl]benzenesulfonamide
CAS Name: 4-chloro-N-[2-chloro-4-(trifluoromethyl)phenyl]benzenesulfonamide
IUPAC NAME: 4-chloro-N-[2-chloro-4-(trifluoromethyl)phenyl]benzenesulfonamide
SYSTEMATIC NAME: 4-chloranyl-N-[2-chloranyl-4-(trifluoromethyl)phenyl]benzenesulfonamide
MOLECULAR FORMULA: C13H8Cl2F3NO2S
MOLECULAR WEIGHT: 370.17433
SMILES: C1=CC(=CC=C1S(=O)(=O)NC2=C(C=C(C=C2)C(F)(F)F)Cl)Cl
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Product OPENEYE NAME: 4-bromo-5-chloro-N-[2-chloro-4-(trifluoromethyl)phenyl]thiophene-2-sulfonamide
CAS Name: 4-bromo-5-chloro-N-[2-chloro-4-(trifluoromethyl)phenyl]-2-thiophenesulfonamide
IUPAC NAME: 4-bromo-5-chloro-N-[2-chloro-4-(trifluoromethyl)phenyl]thiophene-2-sulfonamide
SYSTEMATIC NAME: 4-bromanyl-5-chloranyl-N-[2-chloranyl-4-(trifluoromethyl)phenyl]thiophene-2-sulfonamide
MOLECULAR FORMULA: C11H5BrCl2F3NO2S2
MOLECULAR WEIGHT: 455.09811
SMILES: C1=CC(=C(C=C1C(F)(F)F)Cl)NS(=O)(=O)C2=CC(=C(S2)Cl)Br
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Product OPENEYE NAME: 5-bromo-N-[2-chloro-4-(trifluoromethyl)phenyl]thiophene-2-sulfonamide
CAS Name: 5-bromo-N-[2-chloro-4-(trifluoromethyl)phenyl]-2-thiophenesulfonamide
IUPAC NAME: 5-bromo-N-[2-chloro-4-(trifluoromethyl)phenyl]thiophene-2-sulfonamide
SYSTEMATIC NAME: 5-bromanyl-N-[2-chloranyl-4-(trifluoromethyl)phenyl]thiophene-2-sulfonamide
MOLECULAR FORMULA: C11H6BrClF3NO2S2
MOLECULAR WEIGHT: 420.65305
SMILES: C1=CC(=C(C=C1C(F)(F)F)Cl)NS(=O)(=O)C2=CC=C(S2)Br
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Product OPENEYE NAME: N-[2-chloro-4-(trifluoromethyl)phenyl]-4-fluoro-benzamide
CAS Name: N-[2-chloro-4-(trifluoromethyl)phenyl]-4-fluorobenzamide
IUPAC NAME: N-[2-chloro-4-(trifluoromethyl)phenyl]-4-fluorobenzamide
SYSTEMATIC NAME: N-[2-chloranyl-4-(trifluoromethyl)phenyl]-4-fluoranyl-benzamide
MOLECULAR FORMULA: C14H8ClF4NO
MOLECULAR WEIGHT: 317.666033
SMILES: C1=CC(=CC=C1C(=O)NC2=C(C=C(C=C2)C(F)(F)F)Cl)F
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Product OPENEYE NAME: N-[2-chloro-4-(trifluoromethyl)phenyl]-5-methyl-3-phenyl-isoxazole-4-carboxamide
CAS Name: N-[2-chloro-4-(trifluoromethyl)phenyl]-5-methyl-3-phenyl-4-isoxazolecarboxamide
IUPAC NAME: N-[2-chloro-4-(trifluoromethyl)phenyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide
SYSTEMATIC NAME: N-[2-chloranyl-4-(trifluoromethyl)phenyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide
MOLECULAR FORMULA: C18H12ClF3N2O2
MOLECULAR WEIGHT: 380.74829
SMILES: CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)NC3=C(C=C(C=C3)C(F)(F)F)Cl
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Product OPENEYE NAME: ethyl 4-morpholino-3-[(4-pentylphenyl)sulfonylamino]benzoate
CAS Name: 4-(4-morpholinyl)-3-[(4-pentylphenyl)sulfonylamino]benzoic acid ethyl ester
IUPAC NAME: ethyl 4-morpholin-4-yl-3-[(4-pentylphenyl)sulfonylamino]benzoate
SYSTEMATIC NAME: ethyl 4-morpholin-4-yl-3-[(4-pentylphenyl)sulfonylamino]benzoate
MOLECULAR FORMULA: C24H32N2O5S
MOLECULAR WEIGHT: 460.58628
SMILES: CCCCCC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=CC(=C2)C(=O)OCC)N3CCOCC3
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Product OPENEYE NAME: ethyl 3-[(4-bromo-5-chloro-2-thienyl)sulfonylamino]-4-morpholino-benzoate
CAS Name: 3-[(4-bromo-5-chloro-2-thiophenyl)sulfonylamino]-4-(4-morpholinyl)benzoic acid ethyl ester
IUPAC NAME: ethyl 3-[(4-bromo-5-chlorothiophen-2-yl)sulfonylamino]-4-morpholin-4-ylbenzoate
SYSTEMATIC NAME: ethyl 3-[(4-bromanyl-5-chloranyl-thiophen-2-yl)sulfonylamino]-4-morpholin-4-yl-benzoate
MOLECULAR FORMULA: C17H18BrClN2O5S2
MOLECULAR WEIGHT: 509.82222
SMILES: CCOC(=O)C1=CC(=C(C=C1)N2CCOCC2)NS(=O)(=O)C3=CC(=C(S3)Cl)Br
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Product OPENEYE NAME: methyl 3-[(4-chlorophenyl)methoxy]thiophene-2-carboxylate
CAS Name: 3-[(4-chlorophenyl)methoxy]-2-thiophenecarboxylic acid methyl ester
IUPAC NAME: methyl 3-[(4-chlorophenyl)methoxy]thiophene-2-carboxylate
SYSTEMATIC NAME: methyl 3-[(4-chlorophenyl)methoxy]thiophene-2-carboxylate
MOLECULAR FORMULA: C13H11ClO3S
MOLECULAR WEIGHT: 282.74264
SMILES: COC(=O)C1=C(C=CS1)OCC2=CC=C(C=C2)Cl
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Product OPENEYE NAME: 1-(4-benzyloxyphenyl)-3-[2-[[5-[(dimethylamino)methyl]-2-furyl]methylsulfanyl]ethyl]urea
CAS Name: 1-[2-[[5-[(dimethylamino)methyl]-2-furanyl]methylthio]ethyl]-3-(4-phenylmethoxyphenyl)urea
IUPAC NAME: 1-[2-[[5-[(dimethylamino)methyl]furan-2-yl]methylsulfanyl]ethyl]-3-(4-phenylmethoxyphenyl)urea
SYSTEMATIC NAME: 1-[2-[[5-[(dimethylamino)methyl]furan-2-yl]methylsulfanyl]ethyl]-3-(4-phenylmethoxyphenyl)urea
MOLECULAR FORMULA: C24H29N3O3S
MOLECULAR WEIGHT: 439.57036
SMILES: CN(C)CC1=CC=C(O1)CSCCNC(=O)NC2=CC=C(C=C2)OCC3=CC=CC=C3
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Product OPENEYE NAME: ethyl 4-(5-chloro-1,3-dimethyl-pyrazol-4-yl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
CAS Name: 4-(5-chloro-1,3-dimethyl-4-pyrazolyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester
IUPAC NAME: ethyl 4-(5-chloro-1,3-dimethylpyrazol-4-yl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
SYSTEMATIC NAME: ethyl 4-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate
MOLECULAR FORMULA: C13H17ClN4O3
MOLECULAR WEIGHT: 312.75208
SMILES: CCOC(=O)C1=C(NC(=O)NC1C2=C(N(N=C2C)C)Cl)C
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Product OPENEYE NAME: ethyl 6-methyl-2-oxo-4-[5-(2-phenylethynyl)-2-thienyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate
CAS Name: 6-methyl-2-oxo-4-[5-(2-phenylethynyl)-2-thiophenyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester
IUPAC NAME: ethyl 6-methyl-2-oxo-4-[5-(2-phenylethynyl)thiophen-2-yl]-3,4-dihydro-1H-pyrimidine-5-carboxylate
SYSTEMATIC NAME: ethyl 6-methyl-2-oxidanylidene-4-[5-(2-phenylethynyl)thiophen-2-yl]-3,4-dihydro-1H-pyrimidine-5-carboxylate
MOLECULAR FORMULA: C20H18N2O3S
MOLECULAR WEIGHT: 366.43352
SMILES: CCOC(=O)C1=C(NC(=O)NC1C2=CC=C(S2)C#CC3=CC=CC=C3)C
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Product OPENEYE NAME: ethyl 4-(4-hex-1-ynylphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
CAS Name: 4-(4-hex-1-ynylphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester
IUPAC NAME: ethyl 4-(4-hex-1-ynylphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
SYSTEMATIC NAME: ethyl 4-(4-hex-1-ynylphenyl)-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate
MOLECULAR FORMULA: C20H24N2O3
MOLECULAR WEIGHT: 340.41616
SMILES: CCCCC#CC1=CC=C(C=C1)C2C(=C(NC(=O)N2)C)C(=O)OCC
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Product OPENEYE NAME: 4-benzyl-N-(2,4-difluorophenyl)piperazine-1-carboxamide
CAS Name: N-(2,4-difluorophenyl)-4-(phenylmethyl)-1-piperazinecarboxamide
IUPAC NAME: 4-benzyl-N-(2,4-difluorophenyl)piperazine-1-carboxamide
SYSTEMATIC NAME: N-[2,4-bis(fluoranyl)phenyl]-4-(phenylmethyl)piperazine-1-carboxamide
MOLECULAR FORMULA: C18H19F2N3O
MOLECULAR WEIGHT: 331.359766
SMILES: C1CN(CCN1CC2=CC=CC=C2)C(=O)NC3=C(C=C(C=C3)F)F
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Product OPENEYE NAME: 4-benzyl-N-(5-chloro-2-methoxy-phenyl)piperazine-1-carboxamide
CAS Name: N-(5-chloro-2-methoxyphenyl)-4-(phenylmethyl)-1-piperazinecarboxamide
IUPAC NAME: 4-benzyl-N-(5-chloro-2-methoxyphenyl)piperazine-1-carboxamide
SYSTEMATIC NAME: N-(5-chloranyl-2-methoxy-phenyl)-4-(phenylmethyl)piperazine-1-carboxamide
MOLECULAR FORMULA: C19H22ClN3O2
MOLECULAR WEIGHT: 359.84988
SMILES: COC1=C(C=C(C=C1)Cl)NC(=O)N2CCN(CC2)CC3=CC=CC=C3
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Product OPENEYE NAME: 4-benzyl-N-[4-(trifluoromethoxy)phenyl]piperazine-1-carboxamide
CAS Name: 4-(phenylmethyl)-N-[4-(trifluoromethoxy)phenyl]-1-piperazinecarboxamide
IUPAC NAME: 4-benzyl-N-[4-(trifluoromethoxy)phenyl]piperazine-1-carboxamide
SYSTEMATIC NAME: 4-(phenylmethyl)-N-[4-(trifluoromethyloxy)phenyl]piperazine-1-carboxamide
MOLECULAR FORMULA: C19H20F3N3O2
MOLECULAR WEIGHT: 379.37621
SMILES: C1CN(CCN1CC2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)OC(F)(F)F
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Product OPENEYE NAME: 4-benzyl-N-(3,5-dimethylisoxazol-4-yl)piperazine-1-carboxamide
CAS Name: N-(3,5-dimethyl-4-isoxazolyl)-4-(phenylmethyl)-1-piperazinecarboxamide
IUPAC NAME: 4-benzyl-N-(3,5-dimethyl-1,2-oxazol-4-yl)piperazine-1-carboxamide
SYSTEMATIC NAME: N-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(phenylmethyl)piperazine-1-carboxamide
MOLECULAR FORMULA: C17H22N4O2
MOLECULAR WEIGHT: 314.38218
SMILES: CC1=C(C(=NO1)C)NC(=O)N2CCN(CC2)CC3=CC=CC=C3
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All Chemical Compounds Information

Product OPENEYE NAME: ethyl 2-amino-6-chloro-4-(1-cyano-2-ethoxy-2-oxo-ethyl)-8-methyl-4H-chromene-3-carboxylate
CAS Name: 2-amino-6-chloro-4-(1-cyano-2-ethoxy-2-oxoethyl)-8-methyl-4H-1-benzopyran-3-carboxylic acid ethyl ester
IUPAC NAME: ethyl 2-amino-6-chloro-4-(1-cyano-2-ethoxy-2-oxoethyl)-8-methyl-4H-chromene-3-carboxylate
SYSTEMATIC NAME: ethyl 2-azanyl-6-chloranyl-4-(1-cyano-2-ethoxy-2-oxidanylidene-ethyl)-8-methyl-4H-chromene-3-carboxylate
MOLECULAR FORMULA: C18H19ClN2O5
MOLECULAR WEIGHT: 378.80686
SMILES: CCOC(=O)C1=C(OC2=C(C=C(C=C2C1C(C#N)C(=O)OCC)Cl)C)N
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Product OPENEYE NAME: N-[3-(3-acetamidophenoxy)propyl]-3-(2-chloro-6-fluoro-phenyl)-5-methyl-isoxazole-4-carboxamide
CAS Name: N-[3-(3-acetamidophenoxy)propyl]-3-(2-chloro-6-fluorophenyl)-5-methyl-4-isoxazolecarboxamide
IUPAC NAME: N-[3-(3-acetamidophenoxy)propyl]-3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide
SYSTEMATIC NAME: N-[3-(3-acetamidophenoxy)propyl]-3-(2-chloranyl-6-fluoranyl-phenyl)-5-methyl-1,2-oxazole-4-carboxamide
MOLECULAR FORMULA: C22H21ClFN3O4
MOLECULAR WEIGHT: 445.871243
SMILES: CC1=C(C(=NO1)C2=C(C=CC=C2Cl)F)C(=O)NCCCOC3=CC=CC(=C3)NC(=O)C
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Product OPENEYE NAME: N-[3-(4-acetamidophenoxy)propyl]-5-methyl-3-phenyl-isoxazole-4-carboxamide
CAS Name: N-[3-(4-acetamidophenoxy)propyl]-5-methyl-3-phenyl-4-isoxazolecarboxamide
IUPAC NAME: N-[3-(4-acetamidophenoxy)propyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide
SYSTEMATIC NAME: N-[3-(4-acetamidophenoxy)propyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide
MOLECULAR FORMULA: C22H23N3O4
MOLECULAR WEIGHT: 393.43572
SMILES: CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)NCCCOC3=CC=C(C=C3)NC(=O)C
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Product OPENEYE NAME: N-[3-(3-acetamidophenoxy)propyl]-5-(4-chlorophenyl)-2-(trifluoromethyl)furan-3-carboxamide
CAS Name: N-[3-(3-acetamidophenoxy)propyl]-5-(4-chlorophenyl)-2-(trifluoromethyl)-3-furancarboxamide
IUPAC NAME: N-[3-(3-acetamidophenoxy)propyl]-5-(4-chlorophenyl)-2-(trifluoromethyl)furan-3-carboxamide
SYSTEMATIC NAME: N-[3-(3-acetamidophenoxy)propyl]-5-(4-chlorophenyl)-2-(trifluoromethyl)furan-3-carboxamide
MOLECULAR FORMULA: C23H20ClF3N2O4
MOLECULAR WEIGHT: 480.86411
SMILES: CC(=O)NC1=CC(=CC=C1)OCCCNC(=O)C2=C(OC(=C2)C3=CC=C(C=C3)Cl)C(F)(F)F
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Product OPENEYE NAME: N-[3-(3-acetamidophenoxy)propyl]cyclobutanecarboxamide
CAS Name: N-[3-(3-acetamidophenoxy)propyl]cyclobutanecarboxamide
IUPAC NAME: N-[3-(3-acetamidophenoxy)propyl]cyclobutanecarboxamide
SYSTEMATIC NAME: N-[3-(3-acetamidophenoxy)propyl]cyclobutanecarboxamide
MOLECULAR FORMULA: C16H22N2O3
MOLECULAR WEIGHT: 290.35748
SMILES: CC(=O)NC1=CC(=CC=C1)OCCCNC(=O)C2CCC2
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Product OPENEYE NAME: N-[3-(3-acetamidophenoxy)propyl]-4-fluoro-benzamide
CAS Name: N-[3-(3-acetamidophenoxy)propyl]-4-fluorobenzamide
IUPAC NAME: N-[3-(3-acetamidophenoxy)propyl]-4-fluorobenzamide
SYSTEMATIC NAME: N-[3-(3-acetamidophenoxy)propyl]-4-fluoranyl-benzamide
MOLECULAR FORMULA: C18H19FN2O3
MOLECULAR WEIGHT: 330.353463
SMILES: CC(=O)NC1=CC(=CC=C1)OCCCNC(=O)C2=CC=C(C=C2)F
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Product OPENEYE NAME: N-[3-(3-acetamidophenoxy)propyl]-4-methoxy-benzamide
CAS Name: N-[3-(3-acetamidophenoxy)propyl]-4-methoxybenzamide
IUPAC NAME: N-[3-(3-acetamidophenoxy)propyl]-4-methoxybenzamide
SYSTEMATIC NAME: N-[3-(3-acetamidophenoxy)propyl]-4-methoxy-benzamide
MOLECULAR FORMULA: C19H22N2O4
MOLECULAR WEIGHT: 342.38898
SMILES: CC(=O)NC1=CC(=CC=C1)OCCCNC(=O)C2=CC=C(C=C2)OC
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Product OPENEYE NAME: N-[3-[3-[(1,2-dimethylimidazol-4-yl)sulfonylamino]propoxy]phenyl]acetamide
CAS Name: N-[3-[3-[(1,2-dimethyl-4-imidazolyl)sulfonylamino]propoxy]phenyl]acetamide
IUPAC NAME: N-[3-[3-[(1,2-dimethylimidazol-4-yl)sulfonylamino]propoxy]phenyl]acetamide
SYSTEMATIC NAME: N-[3-[3-[(1,2-dimethylimidazol-4-yl)sulfonylamino]propoxy]phenyl]ethanamide
MOLECULAR FORMULA: C16H22N4O4S
MOLECULAR WEIGHT: 366.43528
SMILES: CC1=NC(=CN1C)S(=O)(=O)NCCCOC2=CC=CC(=C2)NC(=O)C
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Product OPENEYE NAME: N-[3-[3-[(3-chlorophenyl)sulfonylamino]propoxy]phenyl]acetamide
CAS Name: N-[3-[3-[(3-chlorophenyl)sulfonylamino]propoxy]phenyl]acetamide
IUPAC NAME: N-[3-[3-[(3-chlorophenyl)sulfonylamino]propoxy]phenyl]acetamide
SYSTEMATIC NAME: N-[3-[3-[(3-chlorophenyl)sulfonylamino]propoxy]phenyl]ethanamide
MOLECULAR FORMULA: C17H19ClN2O4S
MOLECULAR WEIGHT: 382.86176
SMILES: CC(=O)NC1=CC(=CC=C1)OCCCNS(=O)(=O)C2=CC(=CC=C2)Cl
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Product OPENEYE NAME: N-[3-[3-(2,1,3-benzoxadiazol-4-ylsulfonylamino)propoxy]phenyl]acetamide
CAS Name: N-[3-[3-(2,1,3-benzoxadiazol-4-ylsulfonylamino)propoxy]phenyl]acetamide
IUPAC NAME: N-[3-[3-(2,1,3-benzoxadiazol-4-ylsulfonylamino)propoxy]phenyl]acetamide
SYSTEMATIC NAME: N-[3-[3-(2,1,3-benzoxadiazol-4-ylsulfonylamino)propoxy]phenyl]ethanamide
MOLECULAR FORMULA: C17H18N4O5S
MOLECULAR WEIGHT: 390.41362
SMILES: CC(=O)NC1=CC(=CC=C1)OCCCNS(=O)(=O)C2=CC=CC3=NON=C32
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Product OPENEYE NAME: N-[3-[3-[(3,5-dimethylisoxazol-4-yl)sulfonylamino]propoxy]phenyl]acetamide
CAS Name: N-[3-[3-[(3,5-dimethyl-4-isoxazolyl)sulfonylamino]propoxy]phenyl]acetamide
IUPAC NAME: N-[3-[3-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]propoxy]phenyl]acetamide
SYSTEMATIC NAME: N-[3-[3-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]propoxy]phenyl]ethanamide
MOLECULAR FORMULA: C16H21N3O5S
MOLECULAR WEIGHT: 367.42004
SMILES: CC1=C(C(=NO1)C)S(=O)(=O)NCCCOC2=CC=CC(=C2)NC(=O)C
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Product OPENEYE NAME: N-[3-[3-[[4-(3-chloro-2-cyano-phenoxy)phenyl]sulfonylamino]propoxy]phenyl]acetamide
CAS Name: N-[3-[3-[[4-(3-chloro-2-cyanophenoxy)phenyl]sulfonylamino]propoxy]phenyl]acetamide
IUPAC NAME: N-[3-[3-[[4-(3-chloro-2-cyanophenoxy)phenyl]sulfonylamino]propoxy]phenyl]acetamide
SYSTEMATIC NAME: N-[3-[3-[[4-(3-chloranyl-2-cyano-phenoxy)phenyl]sulfonylamino]propoxy]phenyl]ethanamide
MOLECULAR FORMULA: C24H22ClN3O5S
MOLECULAR WEIGHT: 499.96658
SMILES: CC(=O)NC1=CC(=CC=C1)OCCCNS(=O)(=O)C2=CC=C(C=C2)OC3=C(C(=CC=C3)Cl)C#N
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Product OPENEYE NAME: N-[5-[3-(3-acetamidophenoxy)propylsulfamoyl]-2-thienyl]-4-chloro-N-methyl-benzamide
CAS Name: N-[5-[3-(3-acetamidophenoxy)propylsulfamoyl]-2-thiophenyl]-4-chloro-N-methylbenzamide
IUPAC NAME: N-[5-[3-(3-acetamidophenoxy)propylsulfamoyl]thiophen-2-yl]-4-chloro-N-methylbenzamide
SYSTEMATIC NAME: N-[5-[3-(3-acetamidophenoxy)propylsulfamoyl]thiophen-2-yl]-4-chloranyl-N-methyl-benzamide
MOLECULAR FORMULA: C23H24ClN3O5S2
MOLECULAR WEIGHT: 522.03676
SMILES: CC(=O)NC1=CC(=CC=C1)OCCCNS(=O)(=O)C2=CC=C(S2)N(C)C(=O)C3=CC=C(C=C3)Cl
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Product OPENEYE NAME: N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-2,1,3-benzoxadiazole-4-sulfonamide
CAS Name: N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-2,1,3-benzoxadiazole-4-sulfonamide
IUPAC NAME: N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-2,1,3-benzoxadiazole-4-sulfonamide
SYSTEMATIC NAME: N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-2,1,3-benzoxadiazole-4-sulfonamide
MOLECULAR FORMULA: C11H9N5O3S2
MOLECULAR WEIGHT: 323.35086
SMILES: C1CC1C2=NN=C(S2)NS(=O)(=O)C3=CC=CC4=NON=C43
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Product OPENEYE NAME: 1-(4-nitrophenyl)-5-(2-thienyl)-3-(trifluoromethyl)pyrazole
CAS Name: 1-(4-nitrophenyl)-5-thiophen-2-yl-3-(trifluoromethyl)pyrazole
IUPAC NAME: 1-(4-nitrophenyl)-5-thiophen-2-yl-3-(trifluoromethyl)pyrazole
SYSTEMATIC NAME: 1-(4-nitrophenyl)-5-thiophen-2-yl-3-(trifluoromethyl)pyrazole
MOLECULAR FORMULA: C14H8F3N3O2S
MOLECULAR WEIGHT: 339.29243
SMILES: C1=CSC(=C1)C2=CC(=NN2C3=CC=C(C=C3)[N+](=O)[O-])C(F)(F)F
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All Chemical Compounds Information

Product OPENEYE NAME: ethyl 5-[(4-benzyloxyphenyl)carbamoylamino]-2-(1-piperidyl)benzoate
CAS Name: 5-[[oxo-(4-phenylmethoxyanilino)methyl]amino]-2-(1-piperidinyl)benzoic acid ethyl ester
IUPAC NAME: ethyl 5-[(4-phenylmethoxyphenyl)carbamoylamino]-2-piperidin-1-ylbenzoate
SYSTEMATIC NAME: ethyl 5-[(4-phenylmethoxyphenyl)carbamoylamino]-2-piperidin-1-yl-benzoate
MOLECULAR FORMULA: C28H31N3O4
MOLECULAR WEIGHT: 473.56344
SMILES: CCOC(=O)C1=C(C=CC(=C1)NC(=O)NC2=CC=C(C=C2)OCC3=CC=CC=C3)N4CCCCC4
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Product OPENEYE NAME: 4-amino-2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]pyrimidine-5-carboxylic acid
CAS Name: 4-amino-2-[[3-(trifluoromethyl)phenyl]methylthio]-5-pyrimidinecarboxylic acid
IUPAC NAME: 4-amino-2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]pyrimidine-5-carboxylic acid
SYSTEMATIC NAME: 4-azanyl-2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]pyrimidine-5-carboxylic acid
MOLECULAR FORMULA: C13H10F3N3O2S
MOLECULAR WEIGHT: 329.29761
SMILES: C1=CC(=CC(=C1)C(F)(F)F)CSC2=NC=C(C(=N2)N)C(=O)O
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Product OPENEYE NAME: ethyl 5-(1,3-dioxoisoindolin-2-yl)-2-(1-piperidyl)benzoate
CAS Name: 5-(1,3-dioxo-2-isoindolyl)-2-(1-piperidinyl)benzoic acid ethyl ester
IUPAC NAME: ethyl 5-(1,3-dioxoisoindol-2-yl)-2-piperidin-1-ylbenzoate
SYSTEMATIC NAME: ethyl 5-[1,3-bis(oxidanylidene)isoindol-2-yl]-2-piperidin-1-yl-benzoate
MOLECULAR FORMULA: C22H22N2O4
MOLECULAR WEIGHT: 378.42108
SMILES: CCOC(=O)C1=C(C=CC(=C1)N2C(=O)C3=CC=CC=C3C2=O)N4CCCCC4
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Product OPENEYE NAME: N-(3-bromo-5-methyl-2-pyridyl)-4-pentyl-benzenesulfonamide
CAS Name: N-(3-bromo-5-methyl-2-pyridinyl)-4-pentylbenzenesulfonamide
IUPAC NAME: N-(3-bromo-5-methylpyridin-2-yl)-4-pentylbenzenesulfonamide
SYSTEMATIC NAME: N-(3-bromanyl-5-methyl-pyridin-2-yl)-4-pentyl-benzenesulfonamide
MOLECULAR FORMULA: C17H21BrN2O2S
MOLECULAR WEIGHT: 397.32984
SMILES: CCCCCC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=C(C=N2)C)Br
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Product OPENEYE NAME: 2-[(3-bromo-5-methyl-2-pyridyl)carbamoyl]benzoic acid
CAS Name: 2-[[(3-bromo-5-methyl-2-pyridinyl)amino]-oxomethyl]benzoic acid
IUPAC NAME: 2-[(3-bromo-5-methylpyridin-2-yl)carbamoyl]benzoic acid
SYSTEMATIC NAME: 2-[(3-bromanyl-5-methyl-pyridin-2-yl)carbamoyl]benzoic acid
MOLECULAR FORMULA: C14H11BrN2O3
MOLECULAR WEIGHT: 335.15274
SMILES: CC1=CC(=C(N=C1)NC(=O)C2=CC=CC=C2C(=O)O)Br
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Product OPENEYE NAME: 2-[[2-(carboxymethylsulfanyl)acetyl]amino]-4,5-dimethoxy-benzoic acid
CAS Name: 2-[[2-(carboxymethylthio)-1-oxoethyl]amino]-4,5-dimethoxybenzoic acid
IUPAC NAME: 2-[[2-(carboxymethylsulfanyl)acetyl]amino]-4,5-dimethoxybenzoic acid
SYSTEMATIC NAME: 2-[2-(2-hydroxy-2-oxoethylsulfanyl)ethanoylamino]-4,5-dimethoxy-benzoic acid
MOLECULAR FORMULA: C13H15NO7S
MOLECULAR WEIGHT: 329.3257
SMILES: COC1=C(C=C(C(=C1)C(=O)O)NC(=O)CSCC(=O)O)OC
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Product OPENEYE NAME: 2-[2-oxo-2-[4-[4-(trifluoromethyl)pyrimidin-2-yl]-1,4-diazepan-1-yl]ethyl]sulfanylacetic acid
CAS Name: 2-[[2-oxo-2-[4-[4-(trifluoromethyl)-2-pyrimidinyl]-1,4-diazepan-1-yl]ethyl]thio]acetic acid
IUPAC NAME: 2-[2-oxo-2-[4-[4-(trifluoromethyl)pyrimidin-2-yl]-1,4-diazepan-1-yl]ethyl]sulfanylacetic acid
SYSTEMATIC NAME: 2-[2-oxidanylidene-2-[4-[4-(trifluoromethyl)pyrimidin-2-yl]-1,4-diazepan-1-yl]ethyl]sulfanylethanoic acid
MOLECULAR FORMULA: C14H17F3N4O3S
MOLECULAR WEIGHT: 378.36999
SMILES: C1CN(CCN(C1)C(=O)CSCC(=O)O)C2=NC=CC(=N2)C(F)(F)F
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Product OPENEYE NAME: 2-[2-[3-ethoxycarbonyl-4-(1-piperidyl)anilino]-2-oxo-ethyl]sulfanylacetic acid
CAS Name: 2-[[2-[3-ethoxycarbonyl-4-(1-piperidinyl)anilino]-2-oxoethyl]thio]acetic acid
IUPAC NAME: 2-[2-(3-ethoxycarbonyl-4-piperidin-1-ylanilino)-2-oxoethyl]sulfanylacetic acid
SYSTEMATIC NAME: 2-[2-[(3-ethoxycarbonyl-4-piperidin-1-yl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoic acid
MOLECULAR FORMULA: C18H24N2O5S
MOLECULAR WEIGHT: 380.45856
SMILES: CCOC(=O)C1=C(C=CC(=C1)NC(=O)CSCC(=O)O)N2CCCCC2
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Product OPENEYE NAME: ethyl 2-amino-6-chloro-4-(1-cyano-2-ethoxy-2-oxo-ethyl)-4H-chromene-3-carboxylate
CAS Name: 2-amino-6-chloro-4-(1-cyano-2-ethoxy-2-oxoethyl)-4H-1-benzopyran-3-carboxylic acid ethyl ester
IUPAC NAME: ethyl 2-amino-6-chloro-4-(1-cyano-2-ethoxy-2-oxoethyl)-4H-chromene-3-carboxylate
SYSTEMATIC NAME: ethyl 2-azanyl-6-chloranyl-4-(1-cyano-2-ethoxy-2-oxidanylidene-ethyl)-4H-chromene-3-carboxylate
MOLECULAR FORMULA: C17H17ClN2O5
MOLECULAR WEIGHT: 364.78028
SMILES: CCOC(=O)C1=C(OC2=C(C1C(C#N)C(=O)OCC)C=C(C=C2)Cl)N
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Product OPENEYE NAME: ethyl 2-amino-8-bromo-6-chloro-4-(1-cyano-2-ethoxy-2-oxo-ethyl)-4H-chromene-3-carboxylate
CAS Name: 2-amino-8-bromo-6-chloro-4-(1-cyano-2-ethoxy-2-oxoethyl)-4H-1-benzopyran-3-carboxylic acid ethyl ester
IUPAC NAME: ethyl 2-amino-8-bromo-6-chloro-4-(1-cyano-2-ethoxy-2-oxoethyl)-4H-chromene-3-carboxylate
SYSTEMATIC NAME: ethyl 2-azanyl-8-bromanyl-6-chloranyl-4-(1-cyano-2-ethoxy-2-oxidanylidene-ethyl)-4H-chromene-3-carboxylate
MOLECULAR FORMULA: C17H16BrClN2O5
MOLECULAR WEIGHT: 443.67634
SMILES: CCOC(=O)C1=C(OC2=C(C=C(C=C2C1C(C#N)C(=O)OCC)Cl)Br)N
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Product OPENEYE NAME: ethyl 2-amino-6-bromo-4-(1-cyano-2-ethoxy-2-oxo-ethyl)-8-methoxy-4H-chromene-3-carboxylate
CAS Name: 2-amino-6-bromo-4-(1-cyano-2-ethoxy-2-oxoethyl)-8-methoxy-4H-1-benzopyran-3-carboxylic acid ethyl ester
IUPAC NAME: ethyl 2-amino-6-bromo-4-(1-cyano-2-ethoxy-2-oxoethyl)-8-methoxy-4H-chromene-3-carboxylate
SYSTEMATIC NAME: ethyl 2-azanyl-6-bromanyl-4-(1-cyano-2-ethoxy-2-oxidanylidene-ethyl)-8-methoxy-4H-chromene-3-carboxylate
MOLECULAR FORMULA: C18H19BrN2O6
MOLECULAR WEIGHT: 439.25726
SMILES: CCOC(=O)C1=C(OC2=C(C=C(C=C2C1C(C#N)C(=O)OCC)Br)OC)N
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Product OPENEYE NAME: ethyl 2-amino-6,8-dichloro-4-(1-cyano-2-ethoxy-2-oxo-ethyl)-4H-chromene-3-carboxylate
CAS Name: 2-amino-6,8-dichloro-4-(1-cyano-2-ethoxy-2-oxoethyl)-4H-1-benzopyran-3-carboxylic acid ethyl ester
IUPAC NAME: ethyl 2-amino-6,8-dichloro-4-(1-cyano-2-ethoxy-2-oxoethyl)-4H-chromene-3-carboxylate
SYSTEMATIC NAME: ethyl 2-azanyl-6,8-bis(chloranyl)-4-(1-cyano-2-ethoxy-2-oxidanylidene-ethyl)-4H-chromene-3-carboxylate
MOLECULAR FORMULA: C17H16Cl2N2O5
MOLECULAR WEIGHT: 399.22534
SMILES: CCOC(=O)C1=C(OC2=C(C=C(C=C2C1C(C#N)C(=O)OCC)Cl)Cl)N
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All Chemical Compounds Information

Product OPENEYE NAME: 2-[2-[3-(4-bromo-1-methyl-pyrazol-3-yl)anilino]-2-oxo-ethyl]sulfanylacetic acid
CAS Name: 2-[[2-[3-(4-bromo-1-methyl-3-pyrazolyl)anilino]-2-oxoethyl]thio]acetic acid
IUPAC NAME: 2-[2-[3-(4-bromo-1-methylpyrazol-3-yl)anilino]-2-oxoethyl]sulfanylacetic acid
SYSTEMATIC NAME: 2-[2-[[3-(4-bromanyl-1-methyl-pyrazol-3-yl)phenyl]amino]-2-oxidanylidene-ethyl]sulfanylethanoic acid
MOLECULAR FORMULA: C14H14BrN3O3S
MOLECULAR WEIGHT: 384.24826
SMILES: CN1C=C(C(=N1)C2=CC(=CC=C2)NC(=O)CSCC(=O)O)Br
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Product OPENEYE NAME: 3-[[3-(4-bromo-1-methyl-pyrazol-3-yl)phenyl]carbamoyl]pyrazine-2-carboxylic acid
CAS Name: 3-[[3-(4-bromo-1-methyl-3-pyrazolyl)anilino]-oxomethyl]-2-pyrazinecarboxylic acid
IUPAC NAME: 3-[[3-(4-bromo-1-methylpyrazol-3-yl)phenyl]carbamoyl]pyrazine-2-carboxylic acid
SYSTEMATIC NAME: 3-[[3-(4-bromanyl-1-methyl-pyrazol-3-yl)phenyl]carbamoyl]pyrazine-2-carboxylic acid
MOLECULAR FORMULA: C16H12BrN5O3
MOLECULAR WEIGHT: 402.20218
SMILES: CN1C=C(C(=N1)C2=CC(=CC=C2)NC(=O)C3=NC=CN=C3C(=O)O)Br
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Product OPENEYE NAME: 4-[3-(4-bromo-1-methyl-pyrazol-3-yl)anilino]-4-oxo-butanoic acid
CAS Name: 4-[3-(4-bromo-1-methyl-3-pyrazolyl)anilino]-4-oxobutanoic acid
IUPAC NAME: 4-[3-(4-bromo-1-methylpyrazol-3-yl)anilino]-4-oxobutanoic acid
SYSTEMATIC NAME: 4-[[3-(4-bromanyl-1-methyl-pyrazol-3-yl)phenyl]amino]-4-oxidanylidene-butanoic acid
MOLECULAR FORMULA: C14H14BrN3O3
MOLECULAR WEIGHT: 352.18326
SMILES: CN1C=C(C(=N1)C2=CC(=CC=C2)NC(=O)CCC(=O)O)Br
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Product OPENEYE NAME: 4-[3-(4-bromo-1-methyl-pyrazol-3-yl)anilino]-4-oxo-but-2-enoic acid
CAS Name: 4-[3-(4-bromo-1-methyl-3-pyrazolyl)anilino]-4-oxo-2-butenoic acid
IUPAC NAME: 4-[3-(4-bromo-1-methylpyrazol-3-yl)anilino]-4-oxobut-2-enoic acid
SYSTEMATIC NAME: 4-[[3-(4-bromanyl-1-methyl-pyrazol-3-yl)phenyl]amino]-4-oxidanylidene-but-2-enoic acid
MOLECULAR FORMULA: C14H12BrN3O3
MOLECULAR WEIGHT: 350.16738
SMILES: CN1C=C(C(=N1)C2=CC(=CC=C2)NC(=O)C=CC(=O)O)Br
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Product OPENEYE NAME: 6-[[3-(4-bromo-1-methyl-pyrazol-3-yl)phenyl]carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylic acid
CAS Name: 6-[[3-(4-bromo-1-methyl-3-pyrazolyl)anilino]-oxomethyl]-3,4-dimethyl-1-cyclohex-3-enecarboxylic acid
IUPAC NAME: 6-[[3-(4-bromo-1-methylpyrazol-3-yl)phenyl]carbamoyl]-3,4-dimethylcyclohex-3-ene-1-carboxylic acid
SYSTEMATIC NAME: 6-[[3-(4-bromanyl-1-methyl-pyrazol-3-yl)phenyl]carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylic acid
MOLECULAR FORMULA: C20H22BrN3O3
MOLECULAR WEIGHT: 432.31098
SMILES: CC1=C(CC(C(C1)C(=O)NC2=CC=CC(=C2)C3=NN(C=C3Br)C)C(=O)O)C
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Product OPENEYE NAME: 5-[3-(4-bromo-1-methyl-pyrazol-3-yl)anilino]-3,3-dimethyl-5-oxo-pentanoic acid
CAS Name: 5-[3-(4-bromo-1-methyl-3-pyrazolyl)anilino]-3,3-dimethyl-5-oxopentanoic acid
IUPAC NAME: 5-[3-(4-bromo-1-methylpyrazol-3-yl)anilino]-3,3-dimethyl-5-oxopentanoic acid
SYSTEMATIC NAME: 5-[[3-(4-bromanyl-1-methyl-pyrazol-3-yl)phenyl]amino]-3,3-dimethyl-5-oxidanylidene-pentanoic acid
MOLECULAR FORMULA: C17H20BrN3O3
MOLECULAR WEIGHT: 394.263
SMILES: CC(C)(CC(=O)NC1=CC=CC(=C1)C2=NN(C=C2Br)C)CC(=O)O
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Product OPENEYE NAME: 2-(5-chloro-1-isopropyl-benzimidazol-2-yl)sulfanyl-1-(4-fluorophenyl)ethanone
CAS Name: 2-[(5-chloro-1-propan-2-yl-2-benzimidazolyl)thio]-1-(4-fluorophenyl)ethanone
IUPAC NAME: 2-(5-chloro-1-propan-2-ylbenzimidazol-2-yl)sulfanyl-1-(4-fluorophenyl)ethanone
SYSTEMATIC NAME: 2-(5-chloranyl-1-propan-2-yl-benzimidazol-2-yl)sulfanyl-1-(4-fluorophenyl)ethanone
MOLECULAR FORMULA: C18H16ClFN2OS
MOLECULAR WEIGHT: 362.848843
SMILES: CC(C)N1C2=C(C=C(C=C2)Cl)N=C1SCC(=O)C3=CC=C(C=C3)F
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Product OPENEYE NAME: 5-chloro-1-isopropyl-2-(3-methyl-5-nitro-imidazol-4-yl)sulfanyl-benzimidazole
CAS Name: 5-chloro-2-[(3-methyl-5-nitro-4-imidazolyl)thio]-1-propan-2-ylbenzimidazole
IUPAC NAME: 5-chloro-2-(3-methyl-5-nitroimidazol-4-yl)sulfanyl-1-propan-2-ylbenzimidazole
SYSTEMATIC NAME: 5-chloranyl-2-(3-methyl-5-nitro-imidazol-4-yl)sulfanyl-1-propan-2-yl-benzimidazole
MOLECULAR FORMULA: C14H14ClN5O2S
MOLECULAR WEIGHT: 351.81126
SMILES: CC(C)N1C2=C(C=C(C=C2)Cl)N=C1SC3=C(N=CN3C)[N+](=O)[O-]
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Product OPENEYE NAME: 2-(5-chloro-1-isopropyl-benzimidazol-2-yl)sulfanyl-1-phenyl-ethanone
CAS Name: 2-[(5-chloro-1-propan-2-yl-2-benzimidazolyl)thio]-1-phenylethanone
IUPAC NAME: 2-(5-chloro-1-propan-2-ylbenzimidazol-2-yl)sulfanyl-1-phenylethanone
SYSTEMATIC NAME: 2-(5-chloranyl-1-propan-2-yl-benzimidazol-2-yl)sulfanyl-1-phenyl-ethanone
MOLECULAR FORMULA: C18H17ClN2OS
MOLECULAR WEIGHT: 344.85838
SMILES: CC(C)N1C2=C(C=C(C=C2)Cl)N=C1SCC(=O)C3=CC=CC=C3
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Product OPENEYE NAME: 5-chloro-2-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]-1-isopropyl-benzimidazole
CAS Name: 5-chloro-2-[(2-chloro-6-fluorophenyl)methylthio]-1-propan-2-ylbenzimidazole
IUPAC NAME: 5-chloro-2-[(2-chloro-6-fluorophenyl)methylsulfanyl]-1-propan-2-ylbenzimidazole
SYSTEMATIC NAME: 5-chloranyl-2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-1-propan-2-yl-benzimidazole
MOLECULAR FORMULA: C17H15Cl2FN2S
MOLECULAR WEIGHT: 369.283803
SMILES: CC(C)N1C2=C(C=C(C=C2)Cl)N=C1SCC3=C(C=CC=C3Cl)F
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Product OPENEYE NAME: 4-amino-2-[2-oxo-2-(3-phenylisoxazol-5-yl)ethyl]sulfanyl-pyrimidine-5-carboxylic acid
CAS Name: 4-amino-2-[[2-oxo-2-(3-phenyl-5-isoxazolyl)ethyl]thio]-5-pyrimidinecarboxylic acid
IUPAC NAME: 4-amino-2-[2-oxo-2-(3-phenyl-1,2-oxazol-5-yl)ethyl]sulfanylpyrimidine-5-carboxylic acid
SYSTEMATIC NAME: 4-azanyl-2-[2-oxidanylidene-2-(3-phenyl-1,2-oxazol-5-yl)ethyl]sulfanyl-pyrimidine-5-carboxylic acid
MOLECULAR FORMULA: C16H12N4O4S
MOLECULAR WEIGHT: 356.35588
SMILES: C1=CC=C(C=C1)C2=NOC(=C2)C(=O)CSC3=NC=C(C(=N3)N)C(=O)O
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Product OPENEYE NAME: ethyl 5-[(4-pentylphenyl)sulfonylamino]-2-(1-piperidyl)benzoate
CAS Name: 5-[(4-pentylphenyl)sulfonylamino]-2-(1-piperidinyl)benzoic acid ethyl ester
IUPAC NAME: ethyl 5-[(4-pentylphenyl)sulfonylamino]-2-piperidin-1-ylbenzoate
SYSTEMATIC NAME: ethyl 5-[(4-pentylphenyl)sulfonylamino]-2-piperidin-1-yl-benzoate
MOLECULAR FORMULA: C25H34N2O4S
MOLECULAR WEIGHT: 458.61346
SMILES: CCCCCC1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C(C=C2)N3CCCCC3)C(=O)OCC
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Product OPENEYE NAME: ethyl 2-(1-piperidyl)-5-pyrrol-1-yl-benzoate
CAS Name: 2-(1-piperidinyl)-5-(1-pyrrolyl)benzoic acid ethyl ester
IUPAC NAME: ethyl 2-piperidin-1-yl-5-pyrrol-1-ylbenzoate
SYSTEMATIC NAME: ethyl 2-piperidin-1-yl-5-pyrrol-1-yl-benzoate
MOLECULAR FORMULA: C18H22N2O2
MOLECULAR WEIGHT: 298.37948
SMILES: CCOC(=O)C1=C(C=CC(=C1)N2C=CC=C2)N3CCCCC3
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Product OPENEYE NAME: ethyl 5-(2,5-dimethylpyrrol-1-yl)-2-(1-piperidyl)benzoate
CAS Name: 5-(2,5-dimethyl-1-pyrrolyl)-2-(1-piperidinyl)benzoic acid ethyl ester
IUPAC NAME: ethyl 5-(2,5-dimethylpyrrol-1-yl)-2-piperidin-1-ylbenzoate
SYSTEMATIC NAME: ethyl 5-(2,5-dimethylpyrrol-1-yl)-2-piperidin-1-yl-benzoate
MOLECULAR FORMULA: C20H26N2O2
MOLECULAR WEIGHT: 326.43264
SMILES: CCOC(=O)C1=C(C=CC(=C1)N2C(=CC=C2C)C)N3CCCCC3
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Product OPENEYE NAME: 4-[3-ethoxycarbonyl-4-(1-piperidyl)anilino]-4-oxo-butanoic acid
CAS Name: 4-[3-ethoxycarbonyl-4-(1-piperidinyl)anilino]-4-oxobutanoic acid
IUPAC NAME: 4-(3-ethoxycarbonyl-4-piperidin-1-ylanilino)-4-oxobutanoic acid
SYSTEMATIC NAME: 4-[(3-ethoxycarbonyl-4-piperidin-1-yl-phenyl)amino]-4-oxidanylidene-butanoic acid
MOLECULAR FORMULA: C18H24N2O5
MOLECULAR WEIGHT: 348.39356
SMILES: CCOC(=O)C1=C(C=CC(=C1)NC(=O)CCC(=O)O)N2CCCCC2
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Product OPENEYE NAME: 2-[2-[3-ethoxycarbonyl-4-(1-piperidyl)anilino]-2-oxo-ethoxy]acetic acid
CAS Name: 2-[2-[3-ethoxycarbonyl-4-(1-piperidinyl)anilino]-2-oxoethoxy]acetic acid
IUPAC NAME: 2-[2-(3-ethoxycarbonyl-4-piperidin-1-ylanilino)-2-oxoethoxy]acetic acid
SYSTEMATIC NAME: 2-[2-[(3-ethoxycarbonyl-4-piperidin-1-yl-phenyl)amino]-2-oxidanylidene-ethoxy]ethanoic acid
MOLECULAR FORMULA: C18H24N2O6
MOLECULAR WEIGHT: 364.39296
SMILES: CCOC(=O)C1=C(C=CC(=C1)NC(=O)COCC(=O)O)N2CCCCC2
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Product OPENEYE NAME: 5-[3-ethoxycarbonyl-4-(1-piperidyl)anilino]-3,3-dimethyl-5-oxo-pentanoic acid
CAS Name: 5-[3-ethoxycarbonyl-4-(1-piperidinyl)anilino]-3,3-dimethyl-5-oxopentanoic acid
IUPAC NAME: 5-(3-ethoxycarbonyl-4-piperidin-1-ylanilino)-3,3-dimethyl-5-oxopentanoic acid
SYSTEMATIC NAME: 5-[(3-ethoxycarbonyl-4-piperidin-1-yl-phenyl)amino]-3,3-dimethyl-5-oxidanylidene-pentanoic acid
MOLECULAR FORMULA: C21H30N2O5
MOLECULAR WEIGHT: 390.4733
SMILES: CCOC(=O)C1=C(C=CC(=C1)NC(=O)CC(C)(C)CC(=O)O)N2CCCCC2
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Product OPENEYE NAME: ethyl 5-[(4-fluorophenyl)carbamoylamino]-2-(1-piperidyl)benzoate
CAS Name: 5-[[(4-fluoroanilino)-oxomethyl]amino]-2-(1-piperidinyl)benzoic acid ethyl ester
IUPAC NAME: ethyl 5-[(4-fluorophenyl)carbamoylamino]-2-piperidin-1-ylbenzoate
SYSTEMATIC NAME: ethyl 5-[(4-fluorophenyl)carbamoylamino]-2-piperidin-1-yl-benzoate
MOLECULAR FORMULA: C21H24FN3O3
MOLECULAR WEIGHT: 385.431963
SMILES: CCOC(=O)C1=C(C=CC(=C1)NC(=O)NC2=CC=C(C=C2)F)N3CCCCC3
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Product OPENEYE NAME: ethyl 5-[(3-chloro-4-methyl-phenyl)carbamoylamino]-2-(1-piperidyl)benzoate
CAS Name: 5-[[(3-chloro-4-methylanilino)-oxomethyl]amino]-2-(1-piperidinyl)benzoic acid ethyl ester
IUPAC NAME: ethyl 5-[(3-chloro-4-methylphenyl)carbamoylamino]-2-piperidin-1-ylbenzoate
SYSTEMATIC NAME: ethyl 5-[(3-chloranyl-4-methyl-phenyl)carbamoylamino]-2-piperidin-1-yl-benzoate
MOLECULAR FORMULA: C22H26ClN3O3
MOLECULAR WEIGHT: 415.91314
SMILES: CCOC(=O)C1=C(C=CC(=C1)NC(=O)NC2=CC(=C(C=C2)C)Cl)N3CCCCC3
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Product OPENEYE NAME: ethyl 2-(1-piperidyl)-5-[[4-(trifluoromethyl)phenyl]carbamoylamino]benzoate
CAS Name: 5-[[oxo-[4-(trifluoromethyl)anilino]methyl]amino]-2-(1-piperidinyl)benzoic acid ethyl ester
IUPAC NAME: ethyl 2-piperidin-1-yl-5-[[4-(trifluoromethyl)phenyl]carbamoylamino]benzoate
SYSTEMATIC NAME: ethyl 2-piperidin-1-yl-5-[[4-(trifluoromethyl)phenyl]carbamoylamino]benzoate
MOLECULAR FORMULA: C22H24F3N3O3
MOLECULAR WEIGHT: 435.43947
SMILES: CCOC(=O)C1=C(C=CC(=C1)NC(=O)NC2=CC=C(C=C2)C(F)(F)F)N3CCCCC3
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All Chemical Compounds Information

Product OPENEYE NAME: 4-[2-chloro-4-(dimethylamino)phenyl]-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile
CAS Name: 4-[2-chloro-4-(dimethylamino)phenyl]-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile
IUPAC NAME: 4-[2-chloro-4-(dimethylamino)phenyl]-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile
SYSTEMATIC NAME: 4-[2-chloranyl-4-(dimethylamino)phenyl]-2-methyl-5-oxidanylidene-4,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile
MOLECULAR FORMULA: C19H20ClN3O
MOLECULAR WEIGHT: 341.8346
SMILES: CC1=C(C(C2=C(N1)CCCC2=O)C3=C(C=C(C=C3)N(C)C)Cl)C#N
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Product OPENEYE NAME: 4-[5-[(1,3-dioxoisoindolin-2-yl)methyl]-2-furyl]-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile
CAS Name: 4-[5-[(1,3-dioxo-2-isoindolyl)methyl]-2-furanyl]-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile
IUPAC NAME: 4-[5-[(1,3-dioxoisoindol-2-yl)methyl]furan-2-yl]-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile
SYSTEMATIC NAME: 4-[5-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]furan-2-yl]-2-methyl-5-oxidanylidene-4,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile
MOLECULAR FORMULA: C24H19N3O4
MOLECULAR WEIGHT: 413.42536
SMILES: CC1=C(C(C2=C(N1)CCCC2=O)C3=CC=C(O3)CN4C(=O)C5=CC=CC=C5C4=O)C#N
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Product OPENEYE NAME: benzyl 4-[(4-methoxy-1-methyl-indazol-3-yl)carbamoyl]piperidine-1-carboxylate
CAS Name: 4-[[(4-methoxy-1-methyl-3-indazolyl)amino]-oxomethyl]-1-piperidinecarboxylic acid (phenylmethyl) ester
IUPAC NAME: benzyl 4-[(4-methoxy-1-methylindazol-3-yl)carbamoyl]piperidine-1-carboxylate
SYSTEMATIC NAME: (phenylmethyl) 4-[(4-methoxy-1-methyl-indazol-3-yl)carbamoyl]piperidine-1-carboxylate
MOLECULAR FORMULA: C23H26N4O4
MOLECULAR WEIGHT: 422.47694
SMILES: CN1C2=C(C(=CC=C2)OC)C(=N1)NC(=O)C3CCN(CC3)C(=O)OCC4=CC=CC=C4
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Product OPENEYE NAME: 2-chloro-6-[4-(1-piperidylsulfonyl)phenoxy]benzonitrile
CAS Name: 2-chloro-6-[4-(1-piperidinylsulfonyl)phenoxy]benzonitrile
IUPAC NAME: 2-chloro-6-(4-piperidin-1-ylsulfonylphenoxy)benzonitrile
SYSTEMATIC NAME: 2-chloranyl-6-(4-piperidin-1-ylsulfonylphenoxy)benzenecarbonitrile
MOLECULAR FORMULA: C18H17ClN2O3S
MOLECULAR WEIGHT: 376.85718
SMILES: C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)OC3=C(C(=CC=C3)Cl)C#N
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Product OPENEYE NAME: 2-chloro-6-[4-[4-(2-pyridyl)piperazin-1-yl]sulfonylphenoxy]benzonitrile
CAS Name: 2-chloro-6-[4-[[4-(2-pyridinyl)-1-piperazinyl]sulfonyl]phenoxy]benzonitrile
IUPAC NAME: 2-chloro-6-[4-(4-pyridin-2-ylpiperazin-1-yl)sulfonylphenoxy]benzonitrile
SYSTEMATIC NAME: 2-chloranyl-6-[4-(4-pyridin-2-ylpiperazin-1-yl)sulfonylphenoxy]benzenecarbonitrile
MOLECULAR FORMULA: C22H19ClN4O3S
MOLECULAR WEIGHT: 454.92926
SMILES: C1CN(CCN1C2=CC=CC=N2)S(=O)(=O)C3=CC=C(C=C3)OC4=C(C(=CC=C4)Cl)C#N
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Product OPENEYE NAME: 2-chloro-6-[4-[(4-hydroxy-1-piperidyl)sulfonyl]phenoxy]benzonitrile
CAS Name: 2-chloro-6-[4-[(4-hydroxy-1-piperidinyl)sulfonyl]phenoxy]benzonitrile
IUPAC NAME: 2-chloro-6-[4-(4-hydroxypiperidin-1-yl)sulfonylphenoxy]benzonitrile
SYSTEMATIC NAME: 2-chloranyl-6-[4-(4-oxidanylpiperidin-1-yl)sulfonylphenoxy]benzenecarbonitrile
MOLECULAR FORMULA: C18H17ClN2O4S
MOLECULAR WEIGHT: 392.85658
SMILES: C1CN(CCC1O)S(=O)(=O)C2=CC=C(C=C2)OC3=C(C(=CC=C3)Cl)C#N
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Product OPENEYE NAME: N-(4-tert-butyl-2-methyl-phenyl)-4-(3-chloro-2-cyano-phenoxy)benzenesulfonamide
CAS Name: N-(4-tert-butyl-2-methylphenyl)-4-(3-chloro-2-cyanophenoxy)benzenesulfonamide
IUPAC NAME: N-(4-tert-butyl-2-methylphenyl)-4-(3-chloro-2-cyanophenoxy)benzenesulfonamide
SYSTEMATIC NAME: N-(4-tert-butyl-2-methyl-phenyl)-4-(3-chloranyl-2-cyano-phenoxy)benzenesulfonamide
MOLECULAR FORMULA: C24H23ClN2O3S
MOLECULAR WEIGHT: 454.96902
SMILES: CC1=C(C=CC(=C1)C(C)(C)C)NS(=O)(=O)C2=CC=C(C=C2)OC3=C(C(=CC=C3)Cl)C#N
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Product OPENEYE NAME: 2-chloro-6-[4-[[4-(6-chloro-1,3-benzothiazol-2-yl)-1,4-diazepan-1-yl]sulfonyl]phenoxy]benzonitrile
CAS Name: 2-chloro-6-[4-[[4-(6-chloro-1,3-benzothiazol-2-yl)-1,4-diazepan-1-yl]sulfonyl]phenoxy]benzonitrile
IUPAC NAME: 2-chloro-6-[4-[[4-(6-chloro-1,3-benzothiazol-2-yl)-1,4-diazepan-1-yl]sulfonyl]phenoxy]benzonitrile
SYSTEMATIC NAME: 2-chloranyl-6-[4-[[4-(6-chloranyl-1,3-benzothiazol-2-yl)-1,4-diazepan-1-yl]sulfonyl]phenoxy]benzenecarbonitrile
MOLECULAR FORMULA: C25H20Cl2N4O3S2
MOLECULAR WEIGHT: 559.4873
SMILES: C1CN(CCN(C1)S(=O)(=O)C2=CC=C(C=C2)OC3=C(C(=CC=C3)Cl)C#N)C4=NC5=C(S4)C=C(C=C5)Cl
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Product OPENEYE NAME: 5-[3-(4-bromo-1-methyl-pyrazol-3-yl)anilino]-5-oxo-pentanoic acid
CAS Name: 5-[3-(4-bromo-1-methyl-3-pyrazolyl)anilino]-5-oxopentanoic acid
IUPAC NAME: 5-[3-(4-bromo-1-methylpyrazol-3-yl)anilino]-5-oxopentanoic acid
SYSTEMATIC NAME: 5-[[3-(4-bromanyl-1-methyl-pyrazol-3-yl)phenyl]amino]-5-oxidanylidene-pentanoic acid
MOLECULAR FORMULA: C15H16BrN3O3
MOLECULAR WEIGHT: 366.20984
SMILES: CN1C=C(C(=N1)C2=CC(=CC=C2)NC(=O)CCCC(=O)O)Br
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