Monday, November 26, 2012

All Chemical Compounds Information




Product OPENEYE NAME: (E)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(4-methoxybenzoyl)prop-2-enenitrile
CAS Name: (E)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[(4-methoxyphenyl)-oxomethyl]-2-propenenitrile
IUPAC NAME: (E)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(4-methoxybenzoyl)prop-2-enenitrile
SYSTEMATIC NAME: (E)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(4-methoxyphenyl)carbonyl-prop-2-enenitrile
MOLECULAR FORMULA: C20H18N2O2
MOLECULAR WEIGHT: 318.36912
SMILES: COC1=CC=C(C=C1)C(=O)/C(=C/N2CCC3=CC=CC=C3C2)/C#N
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Product OPENEYE NAME: 5-methyl-2,3-dihydropyrrolo[2,1-b]thiazole-6,7-dicarboxylic acid
CAS Name: 5-methyl-2,3-dihydropyrrolo[2,1-b]thiazole-6,7-dicarboxylic acid
IUPAC NAME: 5-methyl-2,3-dihydropyrrolo[2,1-b][1,3]thiazole-6,7-dicarboxylic acid
SYSTEMATIC NAME: 5-methyl-2,3-dihydropyrrolo[2,1-b][1,3]thiazole-6,7-dicarboxylic acid
MOLECULAR FORMULA: C9H9NO4S
MOLECULAR WEIGHT: 227.23706
SMILES: CC1=C(C(=C2N1CCS2)C(=O)O)C(=O)O
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Product OPENEYE NAME: 2-[1-(4-chlorophenyl)ethylideneamino]oxy-N-(4-methoxyphenyl)acetamide
CAS Name: 2-[1-(4-chlorophenyl)ethylideneamino]oxy-N-(4-methoxyphenyl)acetamide
IUPAC NAME: 2-[1-(4-chlorophenyl)ethylideneamino]oxy-N-(4-methoxyphenyl)acetamide
SYSTEMATIC NAME: 2-[1-(4-chlorophenyl)ethylideneamino]oxy-N-(4-methoxyphenyl)ethanamide
MOLECULAR FORMULA: C17H17ClN2O3
MOLECULAR WEIGHT: 332.78148
SMILES: CC(=NOCC(=O)NC1=CC=C(C=C1)OC)C2=CC=C(C=C2)Cl
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Product OPENEYE NAME: N-[(2-chlorophenyl)methyleneamino]-2-[(4-chlorophenyl)methylsulfanyl]-3-methyl-imidazole-4-carboxamide
CAS Name: N-[(2-chlorophenyl)methylideneamino]-2-[(4-chlorophenyl)methylthio]-3-methyl-4-imidazolecarboxamide
IUPAC NAME: N-[(2-chlorophenyl)methylideneamino]-2-[(4-chlorophenyl)methylsulfanyl]-3-methylimidazole-4-carboxamide
SYSTEMATIC NAME: N-[(2-chlorophenyl)methylideneamino]-2-[(4-chlorophenyl)methylsulfanyl]-3-methyl-imidazole-4-carboxamide
MOLECULAR FORMULA: C19H16Cl2N4OS
MOLECULAR WEIGHT: 419.32754
SMILES: CN1C(=CN=C1SCC2=CC=C(C=C2)Cl)C(=O)NN=CC3=CC=CC=C3Cl
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Product OPENEYE NAME: 2-[(4-chlorophenyl)methylsulfanyl]-3-methyl-N-(2-thienylmethyleneamino)imidazole-4-carboxamide
CAS Name: 2-[(4-chlorophenyl)methylthio]-3-methyl-N-(thiophen-2-ylmethylideneamino)-4-imidazolecarboxamide
IUPAC NAME: 2-[(4-chlorophenyl)methylsulfanyl]-3-methyl-N-(thiophen-2-ylmethylideneamino)imidazole-4-carboxamide
SYSTEMATIC NAME: 2-[(4-chlorophenyl)methylsulfanyl]-3-methyl-N-(thiophen-2-ylmethylideneamino)imidazole-4-carboxamide
MOLECULAR FORMULA: C17H15ClN4OS2
MOLECULAR WEIGHT: 390.9102
SMILES: CN1C(=CN=C1SCC2=CC=C(C=C2)Cl)C(=O)NN=CC3=CC=CS3
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Product OPENEYE NAME: 4-chloro-N-[4-(4-chlorobenzoyl)-1,4-thiazinan-1-ylidene]benzamide
CAS Name: 4-chloro-N-[4-[(4-chlorophenyl)-oxomethyl]-1,4-thiazinan-1-ylidene]benzamide
IUPAC NAME: 4-chloro-N-[4-(4-chlorobenzoyl)-1,4-thiazinan-1-ylidene]benzamide
SYSTEMATIC NAME: 4-chloranyl-N-[4-(4-chlorophenyl)carbonyl-1,4-thiazinan-1-ylidene]benzamide
MOLECULAR FORMULA: C18H16Cl2N2O2S
MOLECULAR WEIGHT: 395.30284
SMILES: C1CS(=NC(=O)C2=CC=C(C=C2)Cl)CCN1C(=O)C3=CC=C(C=C3)Cl
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Product OPENEYE NAME: N-[4-(4-chlorobenzoyl)-1,4-thiazinan-1-ylidene]-4-methoxy-benzamide
CAS Name: N-[4-[(4-chlorophenyl)-oxomethyl]-1,4-thiazinan-1-ylidene]-4-methoxybenzamide
IUPAC NAME: N-[4-(4-chlorobenzoyl)-1,4-thiazinan-1-ylidene]-4-methoxybenzamide
SYSTEMATIC NAME: N-[4-(4-chlorophenyl)carbonyl-1,4-thiazinan-1-ylidene]-4-methoxy-benzamide
MOLECULAR FORMULA: C19H19ClN2O3S
MOLECULAR WEIGHT: 390.88376
SMILES: COC1=CC=C(C=C1)C(=O)N=S2CCN(CC2)C(=O)C3=CC=C(C=C3)Cl
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Product OPENEYE NAME: 1-[4-(4-chlorobenzoyl)-1,4-thiazinan-1-ylidene]-3-(2-methoxyphenyl)urea
CAS Name: 1-[4-[(4-chlorophenyl)-oxomethyl]-1,4-thiazinan-1-ylidene]-3-(2-methoxyphenyl)urea
IUPAC NAME: 1-[4-(4-chlorobenzoyl)-1,4-thiazinan-1-ylidene]-3-(2-methoxyphenyl)urea
SYSTEMATIC NAME: 1-[4-(4-chlorophenyl)carbonyl-1,4-thiazinan-1-ylidene]-3-(2-methoxyphenyl)urea
MOLECULAR FORMULA: C19H20ClN3O3S
MOLECULAR WEIGHT: 405.8984
SMILES: COC1=CC=CC=C1NC(=O)N=S2CCN(CC2)C(=O)C3=CC=C(C=C3)Cl
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Product OPENEYE NAME: 2-[2-(benzenesulfonyl)ethylsulfanyl]pyridine-3-carboxylic acid
CAS Name: 2-[2-(benzenesulfonyl)ethylthio]-3-pyridinecarboxylic acid
IUPAC NAME: 2-[2-(benzenesulfonyl)ethylsulfanyl]pyridine-3-carboxylic acid
SYSTEMATIC NAME: 2-[2-(phenylsulfonyl)ethylsulfanyl]pyridine-3-carboxylic acid
MOLECULAR FORMULA: C14H13NO4S2
MOLECULAR WEIGHT: 323.38732
SMILES: C1=CC=C(C=C1)S(=O)(=O)CCSC2=C(C=CC=N2)C(=O)O
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Product OPENEYE NAME: N-isobutyl-5,7-bis(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CAS Name: N-(2-methylpropyl)-5,7-bis(trifluoromethyl)-3-pyrazolo[1,5-a]pyrimidinecarboxamide
IUPAC NAME: N-(2-methylpropyl)-5,7-bis(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
SYSTEMATIC NAME: N-(2-methylpropyl)-5,7-bis(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
MOLECULAR FORMULA: C13H12F6N4O
MOLECULAR WEIGHT: 354.250999
SMILES: CC(C)CNC(=O)C1=C2N=C(C=C(N2N=C1)C(F)(F)F)C(F)(F)F
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