Thursday, February 2, 2012

All Chemical Compounds Information




Product OPENEYE NAME: N-[2-[2,4-dioxo-5-(2-thienylmethylene)thiazolidin-3-yl]ethyl]-2-(trifluoromethyl)benzamide
CAS Name: N-[2-[2,4-dioxo-5-(thiophen-2-ylmethylidene)-3-thiazolidinyl]ethyl]-2-(trifluoromethyl)benzamide
IUPAC NAME: N-[2-[2,4-dioxo-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]ethyl]-2-(trifluoromethyl)benzamide
SYSTEMATIC NAME: N-[2-[2,4-bis(oxidanylidene)-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]ethyl]-2-(trifluoromethyl)benzamide
MOLECULAR FORMULA: C18H13F3N2O3S2
MOLECULAR WEIGHT: 426.43263
SMILES: C1=CC=C(C(=C1)C(=O)NCCN2C(=O)C(=CC3=CC=CS3)SC2=O)C(F)(F)F
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Product OPENEYE NAME: 2-(2',5'-dioxospiro[chromane-4,4'-imidazolidine]-1'-yl)acetamide
CAS Name: 2-(2',5'-dioxo-1'-spiro[3,4-dihydro-2H-1-benzopyran-4,4'-imidazolidine]yl)acetamide
IUPAC NAME: 2-(2',5'-dioxospiro[2,3-dihydrochromene-4,4'-imidazolidine]-1'-yl)acetamide
SYSTEMATIC NAME: 2-[2',5'-bis(oxidanylidene)spiro[2,3-dihydrochromene-4,4'-imidazolidine]-1'-yl]ethanamide
MOLECULAR FORMULA: C13H13N3O4
MOLECULAR WEIGHT: 275.26002
SMILES: C1COC2=CC=CC=C2C13C(=O)N(C(=O)N3)CC(=O)N
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Product OPENEYE NAME: [2-(2-isopropylanilino)-2-oxo-ethyl] 4-[(3-nitrophenyl)methylene]-2,3-dihydro-1H-acridine-9-carboxylate
CAS Name: 4-[(3-nitrophenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylic acid [2-oxo-2-(2-propan-2-ylanilino)ethyl] ester
IUPAC NAME: [2-oxo-2-(2-propan-2-ylanilino)ethyl] 4-[(3-nitrophenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylate
SYSTEMATIC NAME: [2-oxidanylidene-2-[(2-propan-2-ylphenyl)amino]ethyl] 4-[(3-nitrophenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylate
MOLECULAR FORMULA: C32H29N3O5
MOLECULAR WEIGHT: 535.58976
SMILES: CC(C)C1=CC=CC=C1NC(=O)COC(=O)C2=C3CCCC(=CC4=CC(=CC=C4)[N+](=O)[O-])C3=NC5=CC=CC=C52
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Product OPENEYE NAME: methyl 5-(4-acetoxy-3-methoxy-phenyl)-2-[(2,6-dichlorophenyl)methylene]-7-methyl-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate
CAS Name: 5-(4-acetyloxy-3-methoxyphenyl)-2-[(2,6-dichlorophenyl)methylidene]-7-methyl-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid methyl ester
IUPAC NAME: methyl 5-(4-acetyloxy-3-methoxyphenyl)-2-[(2,6-dichlorophenyl)methylidene]-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
SYSTEMATIC NAME: methyl 5-(4-acetyloxy-3-methoxy-phenyl)-2-[[2,6-bis(chloranyl)phenyl]methylidene]-7-methyl-3-oxidanylidene-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
MOLECULAR FORMULA: C25H20Cl2N2O6S
MOLECULAR WEIGHT: 547.4071
SMILES: CC1=C(C(N2C(=O)C(=CC3=C(C=CC=C3Cl)Cl)SC2=N1)C4=CC(=C(C=C4)OC(=O)C)OC)C(=O)OC
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Product OPENEYE NAME: 5-[[9-methyl-2-(4-methyl-1-piperidyl)-4-oxo-pyrido[1,2-a]pyrimidin-3-yl]methylene]-3-sec-butyl-2-thioxo-thiazolidin-4-one
CAS Name: 3-butan-2-yl-5-[[9-methyl-2-(4-methyl-1-piperidinyl)-4-oxo-3-pyrido[1,2-a]pyrimidinyl]methylidene]-2-sulfanylidene-4-thiazolidinone
IUPAC NAME: 3-butan-2-yl-5-[[9-methyl-2-(4-methylpiperidin-1-yl)-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
SYSTEMATIC NAME: 3-butan-2-yl-5-[[9-methyl-2-(4-methylpiperidin-1-yl)-4-oxidanylidene-pyrido[1,2-a]pyrimidin-3-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
MOLECULAR FORMULA: C23H28N4O2S2
MOLECULAR WEIGHT: 456.62402
SMILES: CCC(C)N1C(=O)C(=CC2=C(N=C3C(=CC=CN3C2=O)C)N4CCC(CC4)C)SC1=S
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Product OPENEYE NAME: allyl 2-[2-(4-bromophenyl)-3-[hydroxy-(4-methoxy-2-methyl-phenyl)methylene]-4,5-dioxo-pyrrolidin-1-yl]-4-methyl-thiazole-5-carboxylate
CAS Name: 2-[2-(4-bromophenyl)-3-[hydroxy-(4-methoxy-2-methylphenyl)methylidene]-4,5-dioxo-1-pyrrolidinyl]-4-methyl-5-thiazolecarboxylic acid prop-2-enyl ester
IUPAC NAME: prop-2-enyl 2-[2-(4-bromophenyl)-3-[hydroxy-(4-methoxy-2-methylphenyl)methylidene]-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
SYSTEMATIC NAME: prop-2-enyl 2-[2-(4-bromophenyl)-3-[(4-methoxy-2-methyl-phenyl)-oxidanyl-methylidene]-4,5-bis(oxidanylidene)pyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
MOLECULAR FORMULA: C27H23BrN2O6S
MOLECULAR WEIGHT: 583.45032
SMILES: CC1=C(C=CC(=C1)OC)C(=C2C(N(C(=O)C2=O)C3=NC(=C(S3)C(=O)OCC=C)C)C4=CC=C(C=C4)Br)O
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Product OPENEYE NAME: 4-[(3-fluoro-4-methoxy-phenyl)-hydroxy-methylene]-5-(2-fluoro-4-pentoxy-phenyl)-1-(4-pyridylmethyl)pyrrolidine-2,3-dione
CAS Name: 4-[(3-fluoro-4-methoxyphenyl)-hydroxymethylidene]-5-(2-fluoro-4-pentoxyphenyl)-1-(pyridin-4-ylmethyl)pyrrolidine-2,3-dione
IUPAC NAME: 4-[(3-fluoro-4-methoxyphenyl)-hydroxymethylidene]-5-(2-fluoro-4-pentoxyphenyl)-1-(pyridin-4-ylmethyl)pyrrolidine-2,3-dione
SYSTEMATIC NAME: 4-[(3-fluoranyl-4-methoxy-phenyl)-oxidanyl-methylidene]-5-(2-fluoranyl-4-pentoxy-phenyl)-1-(pyridin-4-ylmethyl)pyrrolidine-2,3-dione
MOLECULAR FORMULA: C29H28F2N2O5
MOLECULAR WEIGHT: 522.539826
SMILES: CCCCCOC1=CC(=C(C=C1)C2C(=C(C3=CC(=C(C=C3)OC)F)O)C(=O)C(=O)N2CC4=CC=NC=C4)F
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Product OPENEYE NAME: 5-[(4-allyloxy-3-chloro-phenyl)methylene]-3-(4-chlorophenyl)thiazolidine-2,4-dione
CAS Name: 3-(4-chlorophenyl)-5-[(3-chloro-4-prop-2-enoxyphenyl)methylidene]thiazolidine-2,4-dione
IUPAC NAME: 3-(4-chlorophenyl)-5-[(3-chloro-4-prop-2-enoxyphenyl)methylidene]-1,3-thiazolidine-2,4-dione
SYSTEMATIC NAME: 5-[(3-chloranyl-4-prop-2-enoxy-phenyl)methylidene]-3-(4-chlorophenyl)-1,3-thiazolidine-2,4-dione
MOLECULAR FORMULA: C19H13Cl2NO3S
MOLECULAR WEIGHT: 406.28242
SMILES: C=CCOC1=C(C=C(C=C1)C=C2C(=O)N(C(=O)S2)C3=CC=C(C=C3)Cl)Cl
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Product OPENEYE NAME: 2-(7-methyl-4-oxo-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]triazin-3-yl)acetohydrazide
CAS Name: 2-(7-methyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]triazin-3-yl)acetohydrazide
IUPAC NAME: 2-(7-methyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]triazin-3-yl)acetohydrazide
SYSTEMATIC NAME: 2-(7-methyl-4-oxidanylidene-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d][1,2,3]triazin-3-yl)ethanehydrazide
MOLECULAR FORMULA: C12H15N5O2S
MOLECULAR WEIGHT: 293.3448
SMILES: CC1CCC2=C(C1)SC3=C2C(=O)N(N=N3)CC(=O)NN
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Product OPENEYE NAME: 2-[[2-(7-methyl-4-oxo-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]triazin-3-yl)acetyl]amino]-5-phenyl-thiophene-3-carboxamide
CAS Name: 2-[[2-(7-methyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]triazin-3-yl)-1-oxoethyl]amino]-5-phenyl-3-thiophenecarboxamide
IUPAC NAME: 2-[[2-(7-methyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]triazin-3-yl)acetyl]amino]-5-phenylthiophene-3-carboxamide
SYSTEMATIC NAME: 2-[2-(7-methyl-4-oxidanylidene-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d][1,2,3]triazin-3-yl)ethanoylamino]-5-phenyl-thiophene-3-carboxamide
MOLECULAR FORMULA: C23H21N5O3S2
MOLECULAR WEIGHT: 479.57454
SMILES: CC1CCC2=C(C1)SC3=C2C(=O)N(N=N3)CC(=O)NC4=C(C=C(S4)C5=CC=CC=C5)C(=O)N
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Product OPENEYE NAME: N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-2-(7-methyl-4-oxo-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]triazin-3-yl)acetamide
CAS Name: N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-2-(7-methyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]triazin-3-yl)acetamide
IUPAC NAME: N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-2-(7-methyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]triazin-3-yl)acetamide
SYSTEMATIC NAME: N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-2-(7-methyl-4-oxidanylidene-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d][1,2,3]triazin-3-yl)ethanamide
MOLECULAR FORMULA: C20H19N5O2S2
MOLECULAR WEIGHT: 425.52716
SMILES: CC1CCC2=C(C1)SC3=C2C(=O)N(N=N3)CC(=O)NC4=C(C5=C(S4)CCC5)C#N
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Product OPENEYE NAME: 2-(7-methyl-4-oxo-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]triazin-3-yl)-N,N-dipropyl-acetamide
CAS Name: 2-(7-methyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]triazin-3-yl)-N,N-dipropylacetamide
IUPAC NAME: 2-(7-methyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]triazin-3-yl)-N,N-dipropylacetamide
SYSTEMATIC NAME: 2-(7-methyl-4-oxidanylidene-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d][1,2,3]triazin-3-yl)-N,N-dipropyl-ethanamide
MOLECULAR FORMULA: C18H26N4O2S
MOLECULAR WEIGHT: 362.48964
SMILES: CCCN(CCC)C(=O)CN1C(=O)C2=C(N=N1)SC3=C2CCC(C3)C
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Product OPENEYE NAME: N-(2-methoxyethyl)-2-(7-methyl-4-oxo-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]triazin-3-yl)acetamide
CAS Name: N-(2-methoxyethyl)-2-(7-methyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]triazin-3-yl)acetamide
IUPAC NAME: N-(2-methoxyethyl)-2-(7-methyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]triazin-3-yl)acetamide
SYSTEMATIC NAME: N-(2-methoxyethyl)-2-(7-methyl-4-oxidanylidene-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d][1,2,3]triazin-3-yl)ethanamide
MOLECULAR FORMULA: C15H20N4O3S
MOLECULAR WEIGHT: 336.4093
SMILES: CC1CCC2=C(C1)SC3=C2C(=O)N(N=N3)CC(=O)NCCOC
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Product OPENEYE NAME: N-butyl-2-(7-methyl-4-oxo-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]triazin-3-yl)acetamide
CAS Name: N-butyl-2-(7-methyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]triazin-3-yl)acetamide
IUPAC NAME: N-butyl-2-(7-methyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]triazin-3-yl)acetamide
SYSTEMATIC NAME: N-butyl-2-(7-methyl-4-oxidanylidene-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d][1,2,3]triazin-3-yl)ethanamide
MOLECULAR FORMULA: C16H22N4O2S
MOLECULAR WEIGHT: 334.43648
SMILES: CCCCNC(=O)CN1C(=O)C2=C(N=N1)SC3=C2CCC(C3)C
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Product OPENEYE NAME: 3-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxo-ethyl]-7-methyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]triazin-4-one
CAS Name: 3-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]-7-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]triazin-4-one
IUPAC NAME: 3-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]-7-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]triazin-4-one
SYSTEMATIC NAME: 3-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxidanylidene-ethyl]-7-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d][1,2,3]triazin-4-one
MOLECULAR FORMULA: C21H22N4O2S
MOLECULAR WEIGHT: 394.48998
SMILES: CC1CCC2=C(C1)SC3=C2C(=O)N(N=N3)CC(=O)N4CCCC5=CC=CC=C54
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Product OPENEYE NAME: N-isobutyl-2-(7-methyl-4-oxo-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]triazin-3-yl)acetamide
CAS Name: 2-(7-methyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]triazin-3-yl)-N-(2-methylpropyl)acetamide
IUPAC NAME: 2-(7-methyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]triazin-3-yl)-N-(2-methylpropyl)acetamide
SYSTEMATIC NAME: 2-(7-methyl-4-oxidanylidene-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d][1,2,3]triazin-3-yl)-N-(2-methylpropyl)ethanamide
MOLECULAR FORMULA: C16H22N4O2S
MOLECULAR WEIGHT: 334.43648
SMILES: CC1CCC2=C(C1)SC3=C2C(=O)N(N=N3)CC(=O)NCC(C)C
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Product OPENEYE NAME: 2-(7-methyl-4-oxo-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]triazin-3-yl)-N-sec-butyl-acetamide
CAS Name: N-butan-2-yl-2-(7-methyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]triazin-3-yl)acetamide
IUPAC NAME: N-butan-2-yl-2-(7-methyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]triazin-3-yl)acetamide
SYSTEMATIC NAME: N-butan-2-yl-2-(7-methyl-4-oxidanylidene-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d][1,2,3]triazin-3-yl)ethanamide
MOLECULAR FORMULA: C16H22N4O2S
MOLECULAR WEIGHT: 334.43648
SMILES: CCC(C)NC(=O)CN1C(=O)C2=C(N=N1)SC3=C2CCC(C3)C
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Product OPENEYE NAME: N-(2,3-dichlorophenyl)-2-(7-methyl-4-oxo-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]triazin-3-yl)acetamide
CAS Name: N-(2,3-dichlorophenyl)-2-(7-methyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]triazin-3-yl)acetamide
IUPAC NAME: N-(2,3-dichlorophenyl)-2-(7-methyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]triazin-3-yl)acetamide
SYSTEMATIC NAME: N-[2,3-bis(chloranyl)phenyl]-2-(7-methyl-4-oxidanylidene-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d][1,2,3]triazin-3-yl)ethanamide
MOLECULAR FORMULA: C18H16Cl2N4O2S
MOLECULAR WEIGHT: 423.31624
SMILES: CC1CCC2=C(C1)SC3=C2C(=O)N(N=N3)CC(=O)NC4=C(C(=CC=C4)Cl)Cl
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Product OPENEYE NAME: 1-[4-(3-chloro-2-methyl-phenyl)-2'-phenyl-4'-(p-tolyl)spiro[1,3,4-thiadiazole-5,1'-phthalazine]-2-yl]ethanone
CAS Name: 1-[4-(3-chloro-2-methylphenyl)-4'-(4-methylphenyl)-2'-phenyl-2-spiro[1,3,4-thiadiazole-5,1'-phthalazine]yl]ethanone
IUPAC NAME: 1-[4-(3-chloro-2-methylphenyl)-4'-(4-methylphenyl)-2'-phenylspiro[1,3,4-thiadiazole-5,1'-phthalazine]-2-yl]ethanone
SYSTEMATIC NAME: 1-[4-(3-chloranyl-2-methyl-phenyl)-4'-(4-methylphenyl)-2'-phenyl-spiro[1,3,4-thiadiazole-5,1'-phthalazine]-2-yl]ethanone
MOLECULAR FORMULA: C31H25ClN4OS
MOLECULAR WEIGHT: 537.0744
SMILES: CC1=CC=C(C=C1)C2=NN(C3(C4=CC=CC=C42)N(N=C(S3)C(=O)C)C5=C(C(=CC=C5)Cl)C)C6=CC=CC=C6
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Product OPENEYE NAME: ethyl 2-[[1-oxo-2-[2-oxo-2-(1-piperidyl)ethyl]-5-isoquinolyl]oxy]propanoate
CAS Name: 2-[[1-oxo-2-[2-oxo-2-(1-piperidinyl)ethyl]-5-isoquinolinyl]oxy]propanoic acid ethyl ester
IUPAC NAME: ethyl 2-[1-oxo-2-(2-oxo-2-piperidin-1-ylethyl)isoquinolin-5-yl]oxypropanoate
SYSTEMATIC NAME: ethyl 2-[1-oxidanylidene-2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)isoquinolin-5-yl]oxypropanoate
MOLECULAR FORMULA: C21H26N2O5
MOLECULAR WEIGHT: 386.44154
SMILES: CCOC(=O)C(C)OC1=CC=CC2=C1C=CN(C2=O)CC(=O)N3CCCCC3
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Product OPENEYE NAME: 2-chloro-N-[2,3-dihydroxy-2-(hydroxymethyl)propyl]benzamide
CAS Name: 2-chloro-N-[2,3-dihydroxy-2-(hydroxymethyl)propyl]benzamide
IUPAC NAME: 2-chloro-N-[2,3-dihydroxy-2-(hydroxymethyl)propyl]benzamide
SYSTEMATIC NAME: 2-chloranyl-N-[2-(hydroxymethyl)-2,3-bis(oxidanyl)propyl]benzamide
MOLECULAR FORMULA: C11H14ClNO4
MOLECULAR WEIGHT: 259.68616
SMILES: C1=CC=C(C(=C1)C(=O)NCC(CO)(CO)O)Cl
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Product OPENEYE NAME: N-(diisopropylcarbamoyl)-4-(thiadiazol-4-yl)benzamide
CAS Name: N-[[di(propan-2-yl)amino]-oxomethyl]-4-(4-thiadiazolyl)benzamide
IUPAC NAME: N-[di(propan-2-yl)carbamoyl]-4-(thiadiazol-4-yl)benzamide
SYSTEMATIC NAME: N-[di(propan-2-yl)carbamoyl]-4-(1,2,3-thiadiazol-4-yl)benzamide
MOLECULAR FORMULA: C16H20N4O2S
MOLECULAR WEIGHT: 332.4206
SMILES: CC(C)N(C(C)C)C(=O)NC(=O)C1=CC=C(C=C1)C2=CSN=N2
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