Thursday, May 30, 2013

All Chemical Compounds Information




Product OPENEYE NAME: 2-hydroxyethyl 5-(2-thienyl)-1-[3-(trifluoromethyl)phenyl]-1,2,4-triazole-3-carboxylate
CAS Name: 5-thiophen-2-yl-1-[3-(trifluoromethyl)phenyl]-1,2,4-triazole-3-carboxylic acid 2-hydroxyethyl ester
IUPAC NAME: 2-hydroxyethyl 5-thiophen-2-yl-1-[3-(trifluoromethyl)phenyl]-1,2,4-triazole-3-carboxylate
SYSTEMATIC NAME: 2-hydroxyethyl 5-thiophen-2-yl-1-[3-(trifluoromethyl)phenyl]-1,2,4-triazole-3-carboxylate
MOLECULAR FORMULA: C16H12F3N3O3S
MOLECULAR WEIGHT: 383.34499
SMILES: C1=CC(=CC(=C1)N2C(=NC(=N2)C(=O)OCCO)C3=CC=CS3)C(F)(F)F
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Product OPENEYE NAME: N-(2-methoxy-4-nitro-phenyl)-3-[[6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]sulfanyl]propanamide
CAS Name: N-(2-methoxy-4-nitrophenyl)-3-[[6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]thio]propanamide
IUPAC NAME: N-(2-methoxy-4-nitrophenyl)-3-[[6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]sulfanyl]propanamide
SYSTEMATIC NAME: N-(2-methoxy-4-nitro-phenyl)-3-[[6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]sulfanyl]propanamide
MOLECULAR FORMULA: C17H14F3N5O4S
MOLECULAR WEIGHT: 441.38437
SMILES: COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)CCSC2=NN=C3N2C=C(C=C3)C(F)(F)F
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Product OPENEYE NAME: N-[2-[(4-tert-butylphenyl)methyl]pyrazol-3-yl]-2-imidazo[1,2-a]pyridin-2-yl-acetamide
CAS Name: N-[2-[(4-tert-butylphenyl)methyl]-3-pyrazolyl]-2-(2-imidazo[1,2-a]pyridinyl)acetamide
IUPAC NAME: N-[2-[(4-tert-butylphenyl)methyl]pyrazol-3-yl]-2-imidazo[1,2-a]pyridin-2-ylacetamide
SYSTEMATIC NAME: N-[2-[(4-tert-butylphenyl)methyl]pyrazol-3-yl]-2-imidazo[1,2-a]pyridin-2-yl-ethanamide
MOLECULAR FORMULA: C23H25N5O
MOLECULAR WEIGHT: 387.4775
SMILES: CC(C)(C)C1=CC=C(C=C1)CN2C(=CC=N2)NC(=O)CC3=CN4C=CC=CC4=N3
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Product OPENEYE NAME: 2-methyl-N-(1-methylpyrazol-3-yl)-2-phenyl-propanamide
CAS Name: 2-methyl-N-(1-methyl-3-pyrazolyl)-2-phenylpropanamide
IUPAC NAME: 2-methyl-N-(1-methylpyrazol-3-yl)-2-phenylpropanamide
SYSTEMATIC NAME: 2-methyl-N-(1-methylpyrazol-3-yl)-2-phenyl-propanamide
MOLECULAR FORMULA: C14H17N3O
MOLECULAR WEIGHT: 243.30428
SMILES: CC(C)(C1=CC=CC=C1)C(=O)NC2=NN(C=C2)C
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Product OPENEYE NAME: N-[(2-chloro-6-fluoro-phenyl)methyl]-N-cyclopropyl-4-methyl-2-(2-pyridyl)thiazole-5-carboxamide
CAS Name: N-[(2-chloro-6-fluorophenyl)methyl]-N-cyclopropyl-4-methyl-2-(2-pyridinyl)-5-thiazolecarboxamide
IUPAC NAME: N-[(2-chloro-6-fluorophenyl)methyl]-N-cyclopropyl-4-methyl-2-pyridin-2-yl-1,3-thiazole-5-carboxamide
SYSTEMATIC NAME: N-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-N-cyclopropyl-4-methyl-2-pyridin-2-yl-1,3-thiazole-5-carboxamide
MOLECULAR FORMULA: C20H17ClFN3OS
MOLECULAR WEIGHT: 401.884883
SMILES: CC1=C(SC(=N1)C2=CC=CC=N2)C(=O)N(CC3=C(C=CC=C3Cl)F)C4CC4
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Product OPENEYE NAME: imidazo[1,2-a]pyridin-2-ylmethyl 2-(4-chlorophenyl)-5-methyl-oxazole-4-carboxylate
CAS Name: 2-(4-chlorophenyl)-5-methyl-4-oxazolecarboxylic acid 2-imidazo[1,2-a]pyridinylmethyl ester
IUPAC NAME: imidazo[1,2-a]pyridin-2-ylmethyl 2-(4-chlorophenyl)-5-methyl-1,3-oxazole-4-carboxylate
SYSTEMATIC NAME: imidazo[1,2-a]pyridin-2-ylmethyl 2-(4-chlorophenyl)-5-methyl-1,3-oxazole-4-carboxylate
MOLECULAR FORMULA: C19H14ClN3O3
MOLECULAR WEIGHT: 367.78576
SMILES: CC1=C(N=C(O1)C2=CC=C(C=C2)Cl)C(=O)OCC3=CN4C=CC=CC4=N3
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Product OPENEYE NAME: (2-chloro-4-fluoro-phenyl)-[(2S)-2-(1-methylpyrrol-2-yl)azepan-1-yl]methanone
CAS Name: (2-chloro-4-fluorophenyl)-[(2S)-2-(1-methyl-2-pyrrolyl)-1-azepanyl]methanone
IUPAC NAME: (2-chloro-4-fluorophenyl)-[(2S)-2-(1-methylpyrrol-2-yl)azepan-1-yl]methanone
SYSTEMATIC NAME: (2-chloranyl-4-fluoranyl-phenyl)-[(2S)-2-(1-methylpyrrol-2-yl)azepan-1-yl]methanone
MOLECULAR FORMULA: C18H20ClFN2O
MOLECULAR WEIGHT: 334.815603
SMILES: CN1C=CC=C1[C@@H]2CCCCCN2C(=O)C3=C(C=C(C=C3)F)Cl
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Product OPENEYE NAME: (2-chloro-4-fluoro-phenyl)-[(2R)-2-(1-methylpyrrol-2-yl)azepan-1-yl]methanone
CAS Name: (2-chloro-4-fluorophenyl)-[(2R)-2-(1-methyl-2-pyrrolyl)-1-azepanyl]methanone
IUPAC NAME: (2-chloro-4-fluorophenyl)-[(2R)-2-(1-methylpyrrol-2-yl)azepan-1-yl]methanone
SYSTEMATIC NAME: (2-chloranyl-4-fluoranyl-phenyl)-[(2R)-2-(1-methylpyrrol-2-yl)azepan-1-yl]methanone
MOLECULAR FORMULA: C18H20ClFN2O
MOLECULAR WEIGHT: 334.815603
SMILES: CN1C=CC=C1[C@H]2CCCCCN2C(=O)C3=C(C=C(C=C3)F)Cl
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Product OPENEYE NAME: (3,5-difluorophenyl)-[(2S)-2-(1-methylpyrrol-2-yl)azepan-1-yl]methanone
CAS Name: (3,5-difluorophenyl)-[(2S)-2-(1-methyl-2-pyrrolyl)-1-azepanyl]methanone
IUPAC NAME: (3,5-difluorophenyl)-[(2S)-2-(1-methylpyrrol-2-yl)azepan-1-yl]methanone
SYSTEMATIC NAME: [3,5-bis(fluoranyl)phenyl]-[(2S)-2-(1-methylpyrrol-2-yl)azepan-1-yl]methanone
MOLECULAR FORMULA: C18H20F2N2O
MOLECULAR WEIGHT: 318.361006
SMILES: CN1C=CC=C1[C@@H]2CCCCCN2C(=O)C3=CC(=CC(=C3)F)F
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Product OPENEYE NAME: (3,5-difluorophenyl)-[(2R)-2-(1-methylpyrrol-2-yl)azepan-1-yl]methanone
CAS Name: (3,5-difluorophenyl)-[(2R)-2-(1-methyl-2-pyrrolyl)-1-azepanyl]methanone
IUPAC NAME: (3,5-difluorophenyl)-[(2R)-2-(1-methylpyrrol-2-yl)azepan-1-yl]methanone
SYSTEMATIC NAME: [3,5-bis(fluoranyl)phenyl]-[(2R)-2-(1-methylpyrrol-2-yl)azepan-1-yl]methanone
MOLECULAR FORMULA: C18H20F2N2O
MOLECULAR WEIGHT: 318.361006
SMILES: CN1C=CC=C1[C@H]2CCCCCN2C(=O)C3=CC(=CC(=C3)F)F
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Product OPENEYE NAME: 1-[5-[(2R)-2-(1-methylpyrrol-2-yl)azepane-1-carbonyl]-2-thienyl]ethanone
CAS Name: 1-[5-[[(2R)-2-(1-methyl-2-pyrrolyl)-1-azepanyl]-oxomethyl]-2-thiophenyl]ethanone
IUPAC NAME: 1-[5-[(2R)-2-(1-methylpyrrol-2-yl)azepane-1-carbonyl]thiophen-2-yl]ethanone
SYSTEMATIC NAME: 1-[5-[(2R)-2-(1-methylpyrrol-2-yl)azepan-1-yl]carbonylthiophen-2-yl]ethanone
MOLECULAR FORMULA: C18H22N2O2S
MOLECULAR WEIGHT: 330.44448
SMILES: CC(=O)C1=CC=C(S1)C(=O)N2CCCCC[C@@H]2C3=CC=CN3C
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Product OPENEYE NAME: 1-[5-[(2S)-2-(1-methylpyrrol-2-yl)azepane-1-carbonyl]-2-thienyl]ethanone
CAS Name: 1-[5-[[(2S)-2-(1-methyl-2-pyrrolyl)-1-azepanyl]-oxomethyl]-2-thiophenyl]ethanone
IUPAC NAME: 1-[5-[(2S)-2-(1-methylpyrrol-2-yl)azepane-1-carbonyl]thiophen-2-yl]ethanone
SYSTEMATIC NAME: 1-[5-[(2S)-2-(1-methylpyrrol-2-yl)azepan-1-yl]carbonylthiophen-2-yl]ethanone
MOLECULAR FORMULA: C18H22N2O2S
MOLECULAR WEIGHT: 330.44448
SMILES: CC(=O)C1=CC=C(S1)C(=O)N2CCCCC[C@H]2C3=CC=CN3C
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