Sunday, May 5, 2013

All Chemical Compounds Information




Product OPENEYE NAME: [(2S)-tetrahydrofuran-2-yl]methyl 3-phenyl-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepine-1-carboxylate
CAS Name: 3-phenyl-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepine-1-carboxylic acid [(2S)-2-oxolanyl]methyl ester
IUPAC NAME: [(2S)-oxolan-2-yl]methyl 3-phenyl-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepine-1-carboxylate
SYSTEMATIC NAME: [(2S)-oxolan-2-yl]methyl 3-phenyl-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepine-1-carboxylate
MOLECULAR FORMULA: C20H24N2O3
MOLECULAR WEIGHT: 340.41616
SMILES: C1CCC2=C(N=C(N2CC1)C3=CC=CC=C3)C(=O)OC[C@@H]4CCCO4
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Product OPENEYE NAME: 1-(3-fluoro-4-methoxy-phenyl)ethyl 2-acetamidothiazole-4-carboxylate
CAS Name: 2-acetamido-4-thiazolecarboxylic acid 1-(3-fluoro-4-methoxyphenyl)ethyl ester
IUPAC NAME: 1-(3-fluoro-4-methoxyphenyl)ethyl 2-acetamido-1,3-thiazole-4-carboxylate
SYSTEMATIC NAME: 1-(3-fluoranyl-4-methoxy-phenyl)ethyl 2-acetamido-1,3-thiazole-4-carboxylate
MOLECULAR FORMULA: C15H15FN2O4S
MOLECULAR WEIGHT: 338.354003
SMILES: CC(C1=CC(=C(C=C1)OC)F)OC(=O)C2=CSC(=N2)NC(=O)C
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Product OPENEYE NAME: 1-(1,3-benzodioxol-5-yl)ethyl 2-acetamidothiazole-4-carboxylate
CAS Name: 2-acetamido-4-thiazolecarboxylic acid 1-(1,3-benzodioxol-5-yl)ethyl ester
IUPAC NAME: 1-(1,3-benzodioxol-5-yl)ethyl 2-acetamido-1,3-thiazole-4-carboxylate
SYSTEMATIC NAME: 1-(1,3-benzodioxol-5-yl)ethyl 2-acetamido-1,3-thiazole-4-carboxylate
MOLECULAR FORMULA: C15H14N2O5S
MOLECULAR WEIGHT: 334.34706
SMILES: CC(C1=CC2=C(C=C1)OCO2)OC(=O)C3=CSC(=N3)NC(=O)C
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Product OPENEYE NAME: 1-(1,3-benzodioxol-5-yl)ethyl pyrazolo[1,5-a]pyrimidine-3-carboxylate
CAS Name: 3-pyrazolo[1,5-a]pyrimidinecarboxylic acid 1-(1,3-benzodioxol-5-yl)ethyl ester
IUPAC NAME: 1-(1,3-benzodioxol-5-yl)ethyl pyrazolo[1,5-a]pyrimidine-3-carboxylate
SYSTEMATIC NAME: 1-(1,3-benzodioxol-5-yl)ethyl pyrazolo[1,5-a]pyrimidine-3-carboxylate
MOLECULAR FORMULA: C16H13N3O4
MOLECULAR WEIGHT: 311.29212
SMILES: CC(C1=CC2=C(C=C1)OCO2)OC(=O)C3=C4N=CC=CN4N=C3
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Product OPENEYE NAME: 5-acetamido-2-fluoro-N-(4-methoxy-3-methyl-phenyl)sulfonyl-benzamide
CAS Name: 5-acetamido-2-fluoro-N-(4-methoxy-3-methylphenyl)sulfonylbenzamide
IUPAC NAME: 5-acetamido-2-fluoro-N-(4-methoxy-3-methylphenyl)sulfonylbenzamide
SYSTEMATIC NAME: 5-acetamido-2-fluoranyl-N-(4-methoxy-3-methyl-phenyl)sulfonyl-benzamide
MOLECULAR FORMULA: C17H17FN2O5S
MOLECULAR WEIGHT: 380.390683
SMILES: CC1=C(C=CC(=C1)S(=O)(=O)NC(=O)C2=C(C=CC(=C2)NC(=O)C)F)OC
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Product OPENEYE NAME: 3-acetamido-4-fluoro-N-(4-methoxy-3-methyl-phenyl)sulfonyl-benzamide
CAS Name: 3-acetamido-4-fluoro-N-(4-methoxy-3-methylphenyl)sulfonylbenzamide
IUPAC NAME: 3-acetamido-4-fluoro-N-(4-methoxy-3-methylphenyl)sulfonylbenzamide
SYSTEMATIC NAME: 3-acetamido-4-fluoranyl-N-(4-methoxy-3-methyl-phenyl)sulfonyl-benzamide
MOLECULAR FORMULA: C17H17FN2O5S
MOLECULAR WEIGHT: 380.390683
SMILES: CC1=C(C=CC(=C1)S(=O)(=O)NC(=O)C2=CC(=C(C=C2)F)NC(=O)C)OC
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Product OPENEYE NAME: 5-bromo-2-fluoro-N-(4-methoxy-3-methyl-phenyl)sulfonyl-benzamide
CAS Name: 5-bromo-2-fluoro-N-(4-methoxy-3-methylphenyl)sulfonylbenzamide
IUPAC NAME: 5-bromo-2-fluoro-N-(4-methoxy-3-methylphenyl)sulfonylbenzamide
SYSTEMATIC NAME: 5-bromanyl-2-fluoranyl-N-(4-methoxy-3-methyl-phenyl)sulfonyl-benzamide
MOLECULAR FORMULA: C15H13BrFNO4S
MOLECULAR WEIGHT: 402.235423
SMILES: CC1=C(C=CC(=C1)S(=O)(=O)NC(=O)C2=C(C=CC(=C2)Br)F)OC
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Product OPENEYE NAME: 3-(1H-indol-3-yl)-N-(4-methoxy-3-methyl-phenyl)sulfonyl-propanamide
CAS Name: 3-(1H-indol-3-yl)-N-(4-methoxy-3-methylphenyl)sulfonylpropanamide
IUPAC NAME: 3-(1H-indol-3-yl)-N-(4-methoxy-3-methylphenyl)sulfonylpropanamide
SYSTEMATIC NAME: 3-(1H-indol-3-yl)-N-(4-methoxy-3-methyl-phenyl)sulfonyl-propanamide
MOLECULAR FORMULA: C19H20N2O4S
MOLECULAR WEIGHT: 372.4381
SMILES: CC1=C(C=CC(=C1)S(=O)(=O)NC(=O)CCC2=CNC3=CC=CC=C32)OC
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Product OPENEYE NAME: 3-(3-chlorophenyl)-N-(4-methoxy-3-methyl-phenyl)sulfonyl-propanamide
CAS Name: 3-(3-chlorophenyl)-N-(4-methoxy-3-methylphenyl)sulfonylpropanamide
IUPAC NAME: 3-(3-chlorophenyl)-N-(4-methoxy-3-methylphenyl)sulfonylpropanamide
SYSTEMATIC NAME: 3-(3-chlorophenyl)-N-(4-methoxy-3-methyl-phenyl)sulfonyl-propanamide
MOLECULAR FORMULA: C17H18ClNO4S
MOLECULAR WEIGHT: 367.84712
SMILES: CC1=C(C=CC(=C1)S(=O)(=O)NC(=O)CCC2=CC(=CC=C2)Cl)OC
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Product OPENEYE NAME: 3-(2-furyl)-N-(4-methoxy-3-methyl-phenyl)sulfonyl-propanamide
CAS Name: 3-(2-furanyl)-N-(4-methoxy-3-methylphenyl)sulfonylpropanamide
IUPAC NAME: 3-(furan-2-yl)-N-(4-methoxy-3-methylphenyl)sulfonylpropanamide
SYSTEMATIC NAME: 3-(furan-2-yl)-N-(4-methoxy-3-methyl-phenyl)sulfonyl-propanamide
MOLECULAR FORMULA: C15H17NO5S
MOLECULAR WEIGHT: 323.36418
SMILES: CC1=C(C=CC(=C1)S(=O)(=O)NC(=O)CCC2=CC=CO2)OC
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Product OPENEYE NAME: 3-(cyclopropanecarbonylamino)-N-(4-methoxy-3-methyl-phenyl)sulfonyl-benzamide
CAS Name: 3-[[cyclopropyl(oxo)methyl]amino]-N-(4-methoxy-3-methylphenyl)sulfonylbenzamide
IUPAC NAME: 3-(cyclopropanecarbonylamino)-N-(4-methoxy-3-methylphenyl)sulfonylbenzamide
SYSTEMATIC NAME: 3-(cyclopropylcarbonylamino)-N-(4-methoxy-3-methyl-phenyl)sulfonyl-benzamide
MOLECULAR FORMULA: C19H20N2O5S
MOLECULAR WEIGHT: 388.4375
SMILES: CC1=C(C=CC(=C1)S(=O)(=O)NC(=O)C2=CC(=CC=C2)NC(=O)C3CC3)OC
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Product OPENEYE NAME: 3-acetamido-N-(4-methoxy-3-methyl-phenyl)sulfonyl-propanamide
CAS Name: 3-acetamido-N-(4-methoxy-3-methylphenyl)sulfonylpropanamide
IUPAC NAME: 3-acetamido-N-(4-methoxy-3-methylphenyl)sulfonylpropanamide
SYSTEMATIC NAME: 3-acetamido-N-(4-methoxy-3-methyl-phenyl)sulfonyl-propanamide
MOLECULAR FORMULA: C13H18N2O5S
MOLECULAR WEIGHT: 314.35742
SMILES: CC1=C(C=CC(=C1)S(=O)(=O)NC(=O)CCNC(=O)C)OC
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Product OPENEYE NAME: 1-(4-fluorophenyl)-N-(4-methoxy-3-methyl-phenyl)sulfonyl-5-methyl-pyrazole-4-carboxamide
CAS Name: 1-(4-fluorophenyl)-N-(4-methoxy-3-methylphenyl)sulfonyl-5-methyl-4-pyrazolecarboxamide
IUPAC NAME: 1-(4-fluorophenyl)-N-(4-methoxy-3-methylphenyl)sulfonyl-5-methylpyrazole-4-carboxamide
SYSTEMATIC NAME: 1-(4-fluorophenyl)-N-(4-methoxy-3-methyl-phenyl)sulfonyl-5-methyl-pyrazole-4-carboxamide
MOLECULAR FORMULA: C19H18FN3O4S
MOLECULAR WEIGHT: 403.427323
SMILES: CC1=C(C=CC(=C1)S(=O)(=O)NC(=O)C2=C(N(N=C2)C3=CC=C(C=C3)F)C)OC
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Product OPENEYE NAME: N-(4-methoxy-3-methyl-phenyl)sulfonylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CAS Name: N-(4-methoxy-3-methylphenyl)sulfonyl-3-pyrazolo[1,5-a]pyrimidinecarboxamide
IUPAC NAME: N-(4-methoxy-3-methylphenyl)sulfonylpyrazolo[1,5-a]pyrimidine-3-carboxamide
SYSTEMATIC NAME: N-(4-methoxy-3-methyl-phenyl)sulfonylpyrazolo[1,5-a]pyrimidine-3-carboxamide
MOLECULAR FORMULA: C15H14N4O4S
MOLECULAR WEIGHT: 346.36106
SMILES: CC1=C(C=CC(=C1)S(=O)(=O)NC(=O)C2=C3N=CC=CN3N=C2)OC
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