Monday, April 2, 2012

All Chemical Compounds Information




Product OPENEYE NAME: methyl 1-allyl-4-[(4-bromophenyl)methylene]-2-methyl-5-oxo-pyrrole-3-carboxylate
CAS Name: 4-[(4-bromophenyl)methylidene]-2-methyl-5-oxo-1-prop-2-enyl-3-pyrrolecarboxylic acid methyl ester
IUPAC NAME: methyl 4-[(4-bromophenyl)methylidene]-2-methyl-5-oxo-1-prop-2-enylpyrrole-3-carboxylate
SYSTEMATIC NAME: methyl 4-[(4-bromophenyl)methylidene]-2-methyl-5-oxidanylidene-1-prop-2-enyl-pyrrole-3-carboxylate
MOLECULAR FORMULA: C17H16BrNO3
MOLECULAR WEIGHT: 362.21784
SMILES: CC1=C(C(=CC2=CC=C(C=C2)Br)C(=O)N1CC=C)C(=O)OC
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Product OPENEYE NAME: ethyl 4-[(5-bromo-2-methoxy-phenyl)methylene]-2-methyl-5-oxo-1-(p-tolyl)pyrrole-3-carboxylate
CAS Name: 4-[(5-bromo-2-methoxyphenyl)methylidene]-2-methyl-1-(4-methylphenyl)-5-oxo-3-pyrrolecarboxylic acid ethyl ester
IUPAC NAME: ethyl 4-[(5-bromo-2-methoxyphenyl)methylidene]-2-methyl-1-(4-methylphenyl)-5-oxopyrrole-3-carboxylate
SYSTEMATIC NAME: ethyl 4-[(5-bromanyl-2-methoxy-phenyl)methylidene]-2-methyl-1-(4-methylphenyl)-5-oxidanylidene-pyrrole-3-carboxylate
MOLECULAR FORMULA: C23H22BrNO4
MOLECULAR WEIGHT: 456.32908
SMILES: CCOC(=O)C1=C(N(C(=O)C1=CC2=C(C=CC(=C2)Br)OC)C3=CC=C(C=C3)C)C
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Product OPENEYE NAME: 2-[benzyl-(3,4-dimethoxyphenyl)sulfonyl-amino]-N-(5-chloro-2-methyl-phenyl)acetamide
CAS Name: N-(5-chloro-2-methylphenyl)-2-[(3,4-dimethoxyphenyl)sulfonyl-(phenylmethyl)amino]acetamide
IUPAC NAME: 2-[benzyl-(3,4-dimethoxyphenyl)sulfonylamino]-N-(5-chloro-2-methylphenyl)acetamide
SYSTEMATIC NAME: N-(5-chloranyl-2-methyl-phenyl)-2-[(3,4-dimethoxyphenyl)sulfonyl-(phenylmethyl)amino]ethanamide
MOLECULAR FORMULA: C24H25ClN2O5S
MOLECULAR WEIGHT: 488.9837
SMILES: CC1=C(C=C(C=C1)Cl)NC(=O)CN(CC2=CC=CC=C2)S(=O)(=O)C3=CC(=C(C=C3)OC)OC
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Product OPENEYE NAME: 2-[(3,4-dimethoxyphenyl)sulfonyl-(2-phenylethyl)amino]-N-[[(2R)-tetrahydrofuran-2-yl]methyl]acetamide
CAS Name: 2-[(3,4-dimethoxyphenyl)sulfonyl-(2-phenylethyl)amino]-N-[[(2R)-2-oxolanyl]methyl]acetamide
IUPAC NAME: 2-[(3,4-dimethoxyphenyl)sulfonyl-(2-phenylethyl)amino]-N-[[(2R)-oxolan-2-yl]methyl]acetamide
SYSTEMATIC NAME: 2-[(3,4-dimethoxyphenyl)sulfonyl-(2-phenylethyl)amino]-N-[[(2R)-oxolan-2-yl]methyl]ethanamide
MOLECULAR FORMULA: C23H30N2O6S
MOLECULAR WEIGHT: 462.5591
SMILES: COC1=C(C=C(C=C1)S(=O)(=O)N(CCC2=CC=CC=C2)CC(=O)NC[C@H]3CCCO3)OC
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Product OPENEYE NAME: 2-[(3,4-dimethoxyphenyl)sulfonyl-(2-phenylethyl)amino]-N-[[(2S)-tetrahydrofuran-2-yl]methyl]acetamide
CAS Name: 2-[(3,4-dimethoxyphenyl)sulfonyl-(2-phenylethyl)amino]-N-[[(2S)-2-oxolanyl]methyl]acetamide
IUPAC NAME: 2-[(3,4-dimethoxyphenyl)sulfonyl-(2-phenylethyl)amino]-N-[[(2S)-oxolan-2-yl]methyl]acetamide
SYSTEMATIC NAME: 2-[(3,4-dimethoxyphenyl)sulfonyl-(2-phenylethyl)amino]-N-[[(2S)-oxolan-2-yl]methyl]ethanamide
MOLECULAR FORMULA: C23H30N2O6S
MOLECULAR WEIGHT: 462.5591
SMILES: COC1=C(C=C(C=C1)S(=O)(=O)N(CCC2=CC=CC=C2)CC(=O)NC[C@@H]3CCCO3)OC
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Product OPENEYE NAME: 2-[(3,4-dimethoxyphenyl)sulfonyl-(2-phenylethyl)amino]-N-(3-pyridylmethyl)acetamide
CAS Name: 2-[(3,4-dimethoxyphenyl)sulfonyl-(2-phenylethyl)amino]-N-(3-pyridinylmethyl)acetamide
IUPAC NAME: 2-[(3,4-dimethoxyphenyl)sulfonyl-(2-phenylethyl)amino]-N-(pyridin-3-ylmethyl)acetamide
SYSTEMATIC NAME: 2-[(3,4-dimethoxyphenyl)sulfonyl-(2-phenylethyl)amino]-N-(pyridin-3-ylmethyl)ethanamide
MOLECULAR FORMULA: C24H27N3O5S
MOLECULAR WEIGHT: 469.55328
SMILES: COC1=C(C=C(C=C1)S(=O)(=O)N(CCC2=CC=CC=C2)CC(=O)NCC3=CN=CC=C3)OC
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Product OPENEYE NAME: methyl 5-[(4-methoxyphenyl)methylene]-2-methyl-4-oxo-1-(p-tolyl)pyrrole-3-carboxylate
CAS Name: 5-[(4-methoxyphenyl)methylidene]-2-methyl-1-(4-methylphenyl)-4-oxo-3-pyrrolecarboxylic acid methyl ester
IUPAC NAME: methyl 5-[(4-methoxyphenyl)methylidene]-2-methyl-1-(4-methylphenyl)-4-oxopyrrole-3-carboxylate
SYSTEMATIC NAME: methyl 5-[(4-methoxyphenyl)methylidene]-2-methyl-1-(4-methylphenyl)-4-oxidanylidene-pyrrole-3-carboxylate
MOLECULAR FORMULA: C22H21NO4
MOLECULAR WEIGHT: 363.40644
SMILES: CC1=CC=C(C=C1)N2C(=C(C(=O)C2=CC3=CC=C(C=C3)OC)C(=O)OC)C
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Product OPENEYE NAME: ethyl 5-acetoxy-6-bromo-2-[(3-cyano-6-methyl-2-pyridyl)sulfanylmethyl]-1-methyl-indole-3-carboxylate
CAS Name: 5-acetyloxy-6-bromo-2-[[(3-cyano-6-methyl-2-pyridinyl)thio]methyl]-1-methyl-3-indolecarboxylic acid ethyl ester
IUPAC NAME: ethyl 5-acetyloxy-6-bromo-2-[(3-cyano-6-methylpyridin-2-yl)sulfanylmethyl]-1-methylindole-3-carboxylate
SYSTEMATIC NAME: ethyl 5-acetyloxy-6-bromanyl-2-[(3-cyano-6-methyl-pyridin-2-yl)sulfanylmethyl]-1-methyl-indole-3-carboxylate
MOLECULAR FORMULA: C22H20BrN3O4S
MOLECULAR WEIGHT: 502.3809
SMILES: CCOC(=O)C1=C(N(C2=CC(=C(C=C21)OC(=O)C)Br)C)CSC3=C(C=CC(=N3)C)C#N
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Product OPENEYE NAME: 3,6-diamino-2-(4-bromobenzoyl)-4-isopropyl-thieno[2,3-b]pyridine-5-carbonitrile
CAS Name: 3,6-diamino-2-[(4-bromophenyl)-oxomethyl]-4-propan-2-yl-5-thieno[2,3-b]pyridinecarbonitrile
IUPAC NAME: 3,6-diamino-2-(4-bromobenzoyl)-4-propan-2-ylthieno[2,3-b]pyridine-5-carbonitrile
SYSTEMATIC NAME: 3,6-bis(azanyl)-2-(4-bromophenyl)carbonyl-4-propan-2-yl-thieno[2,3-b]pyridine-5-carbonitrile
MOLECULAR FORMULA: C18H15BrN4OS
MOLECULAR WEIGHT: 415.3069
SMILES: CC(C)C1=C(C(=NC2=C1C(=C(S2)C(=O)C3=CC=C(C=C3)Br)N)N)C#N
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Product OPENEYE NAME: ethyl 2-[(3-methylbenzoyl)amino]-4-(2-thienyl)thiophene-3-carboxylate
CAS Name: 2-[[(3-methylphenyl)-oxomethyl]amino]-4-thiophen-2-yl-3-thiophenecarboxylic acid ethyl ester
IUPAC NAME: ethyl 2-[(3-methylbenzoyl)amino]-4-thiophen-2-ylthiophene-3-carboxylate
SYSTEMATIC NAME: ethyl 2-[(3-methylphenyl)carbonylamino]-4-thiophen-2-yl-thiophene-3-carboxylate
MOLECULAR FORMULA: C19H17NO3S2
MOLECULAR WEIGHT: 371.47318
SMILES: CCOC(=O)C1=C(SC=C1C2=CC=CS2)NC(=O)C3=CC(=CC=C3)C
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Product OPENEYE NAME: (2S)-3-(4-chlorophenyl)sulfonyl-2-(trichloromethyl)oxazolidine
CAS Name: (2S)-3-(4-chlorophenyl)sulfonyl-2-(trichloromethyl)oxazolidine
IUPAC NAME: (2S)-3-(4-chlorophenyl)sulfonyl-2-(trichloromethyl)-1,3-oxazolidine
SYSTEMATIC NAME: (2S)-3-(4-chlorophenyl)sulfonyl-2-(trichloromethyl)-1,3-oxazolidine
MOLECULAR FORMULA: C10H9Cl4NO3S
MOLECULAR WEIGHT: 365.06036
SMILES: C1CO[C@H](N1S(=O)(=O)C2=CC=C(C=C2)Cl)C(Cl)(Cl)Cl
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Product OPENEYE NAME: (2R)-3-(4-chlorophenyl)sulfonyl-2-(trichloromethyl)oxazolidine
CAS Name: (2R)-3-(4-chlorophenyl)sulfonyl-2-(trichloromethyl)oxazolidine
IUPAC NAME: (2R)-3-(4-chlorophenyl)sulfonyl-2-(trichloromethyl)-1,3-oxazolidine
SYSTEMATIC NAME: (2R)-3-(4-chlorophenyl)sulfonyl-2-(trichloromethyl)-1,3-oxazolidine
MOLECULAR FORMULA: C10H9Cl4NO3S
MOLECULAR WEIGHT: 365.06036
SMILES: C1CO[C@@H](N1S(=O)(=O)C2=CC=C(C=C2)Cl)C(Cl)(Cl)Cl
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Product OPENEYE NAME: 4-chloro-N-[(1S)-2,2,2-trichloro-1-(2-thienyl)ethyl]benzenesulfonamide
CAS Name: 4-chloro-N-[(1S)-2,2,2-trichloro-1-thiophen-2-ylethyl]benzenesulfonamide
IUPAC NAME: 4-chloro-N-[(1S)-2,2,2-trichloro-1-thiophen-2-ylethyl]benzenesulfonamide
SYSTEMATIC NAME: 4-chloranyl-N-[(1S)-2,2,2-tris(chloranyl)-1-thiophen-2-yl-ethyl]benzenesulfonamide
MOLECULAR FORMULA: C12H9Cl4NO2S2
MOLECULAR WEIGHT: 405.14736
SMILES: C1=CSC(=C1)[C@@H](C(Cl)(Cl)Cl)NS(=O)(=O)C2=CC=C(C=C2)Cl
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