Tuesday, February 26, 2013

All Chemical Compounds Information




Product OPENEYE NAME: N-(isopentylcarbamoyl)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-acetamide
CAS Name: N-[(3-methylbutylamino)-oxomethyl]-2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]acetamide
IUPAC NAME: N-(3-methylbutylcarbamoyl)-2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanylacetamide
SYSTEMATIC NAME: N-(3-methylbutylcarbamoyl)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-ethanamide
MOLECULAR FORMULA: C19H24N4O2S
MOLECULAR WEIGHT: 372.48446
SMILES: CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC(=O)NC(=O)NCCC(C)C
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Product OPENEYE NAME: (2S)-2-(4-acetyl-2-methoxy-phenoxy)-N-(3-chloro-4-cyano-phenyl)propanamide
CAS Name: (2S)-2-(4-acetyl-2-methoxyphenoxy)-N-(3-chloro-4-cyanophenyl)propanamide
IUPAC NAME: (2S)-2-(4-acetyl-2-methoxyphenoxy)-N-(3-chloro-4-cyanophenyl)propanamide
SYSTEMATIC NAME: (2S)-N-(3-chloranyl-4-cyano-phenyl)-2-(4-ethanoyl-2-methoxy-phenoxy)propanamide
MOLECULAR FORMULA: C19H17ClN2O4
MOLECULAR WEIGHT: 372.80228
SMILES: C[C@@H](C(=O)NC1=CC(=C(C=C1)C#N)Cl)OC2=C(C=C(C=C2)C(=O)C)OC
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Product OPENEYE NAME: 2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-[[(1S)-1-methylpropyl]carbamoyl]acetamide
CAS Name: N-[[[(2S)-butan-2-yl]amino]-oxomethyl]-2-[4-(2,4-dimethylphenyl)sulfonyl-1-piperazin-1-iumyl]acetamide
IUPAC NAME: N-[[(2S)-butan-2-yl]carbamoyl]-2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]acetamide
SYSTEMATIC NAME: N-[[(2S)-butan-2-yl]carbamoyl]-2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]ethanamide
MOLECULAR FORMULA: C19H31N4O4S+
MOLECULAR WEIGHT: 411.53884
SMILES: CC[C@H](C)NC(=O)NC(=O)C[NH+]1CCN(CC1)S(=O)(=O)C2=C(C=C(C=C2)C)C
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Product OPENEYE NAME: 2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-N-[[(1S)-1-methylpropyl]carbamoyl]acetamide
CAS Name: N-[[[(2S)-butan-2-yl]amino]-oxomethyl]-2-[4-(2,4-dimethylphenyl)sulfonyl-1-piperazinyl]acetamide
IUPAC NAME: N-[[(2S)-butan-2-yl]carbamoyl]-2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]acetamide
SYSTEMATIC NAME: N-[[(2S)-butan-2-yl]carbamoyl]-2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]ethanamide
MOLECULAR FORMULA: C19H30N4O4S
MOLECULAR WEIGHT: 410.5309
SMILES: CC[C@H](C)NC(=O)NC(=O)CN1CCN(CC1)S(=O)(=O)C2=C(C=C(C=C2)C)C
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Product OPENEYE NAME: [(1S)-2-(4-ethoxyphenyl)-1-methyl-2-oxo-ethyl] 6-methyl-4-oxo-chromene-2-carboxylate
CAS Name: 6-methyl-4-oxo-1-benzopyran-2-carboxylic acid [(2S)-1-(4-ethoxyphenyl)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2S)-1-(4-ethoxyphenyl)-1-oxopropan-2-yl] 6-methyl-4-oxochromene-2-carboxylate
SYSTEMATIC NAME: [(2S)-1-(4-ethoxyphenyl)-1-oxidanylidene-propan-2-yl] 6-methyl-4-oxidanylidene-chromene-2-carboxylate
MOLECULAR FORMULA: C22H20O6
MOLECULAR WEIGHT: 380.3906
SMILES: CCOC1=CC=C(C=C1)C(=O)[C@H](C)OC(=O)C2=CC(=O)C3=C(O2)C=CC(=C3)C
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Product OPENEYE NAME: N-[2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylacetyl]benzamide
CAS Name: N-[2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]-1-oxoethyl]benzamide
IUPAC NAME: N-[2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanylacetyl]benzamide
SYSTEMATIC NAME: N-[2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylethanoyl]benzamide
MOLECULAR FORMULA: C20H17N3O2S
MOLECULAR WEIGHT: 363.43288
SMILES: CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC(=O)NC(=O)C3=CC=CC=C3
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Product OPENEYE NAME: (2R)-2-(4-acetyl-2-methoxy-phenoxy)-N-(3-chloro-4-cyano-phenyl)propanamide
CAS Name: (2R)-2-(4-acetyl-2-methoxyphenoxy)-N-(3-chloro-4-cyanophenyl)propanamide
IUPAC NAME: (2R)-2-(4-acetyl-2-methoxyphenoxy)-N-(3-chloro-4-cyanophenyl)propanamide
SYSTEMATIC NAME: (2R)-N-(3-chloranyl-4-cyano-phenyl)-2-(4-ethanoyl-2-methoxy-phenoxy)propanamide
MOLECULAR FORMULA: C19H17ClN2O4
MOLECULAR WEIGHT: 372.80228
SMILES: C[C@H](C(=O)NC1=CC(=C(C=C1)C#N)Cl)OC2=C(C=C(C=C2)C(=O)C)OC
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Product OPENEYE NAME: dimethyl-[2-[[[2-[methyl(p-tolylsulfonyl)amino]acetyl]amino]carbamothioylamino]ethyl]ammonium
CAS Name: dimethyl-[2-[[[[2-[methyl-(4-methylphenyl)sulfonylamino]-1-oxoethyl]hydrazo]-sulfanylidenemethyl]amino]ethyl]ammonium
IUPAC NAME: dimethyl-[2-[[[2-[methyl-(4-methylphenyl)sulfonylamino]acetyl]amino]carbamothioylamino]ethyl]azanium
SYSTEMATIC NAME: dimethyl-[2-[[2-[methyl-(4-methylphenyl)sulfonyl-amino]ethanoylamino]carbamothioylamino]ethyl]azanium
MOLECULAR FORMULA: C15H26N5O3S2+
MOLECULAR WEIGHT: 388.52864
SMILES: CC1=CC=C(C=C1)S(=O)(=O)N(C)CC(=O)NNC(=S)NCC[NH+](C)C
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Product OPENEYE NAME: 1-[2-(dimethylamino)ethyl]-3-[[2-[methyl(p-tolylsulfonyl)amino]acetyl]amino]thiourea
CAS Name: 1-[2-(dimethylamino)ethyl]-3-[[2-[methyl-(4-methylphenyl)sulfonylamino]-1-oxoethyl]amino]thiourea
IUPAC NAME: 1-[2-(dimethylamino)ethyl]-3-[[2-[methyl-(4-methylphenyl)sulfonylamino]acetyl]amino]thiourea
SYSTEMATIC NAME: 1-[2-(dimethylamino)ethyl]-3-[2-[methyl-(4-methylphenyl)sulfonyl-amino]ethanoylamino]thiourea
MOLECULAR FORMULA: C15H25N5O3S2
MOLECULAR WEIGHT: 387.5207
SMILES: CC1=CC=C(C=C1)S(=O)(=O)N(C)CC(=O)NNC(=S)NCCN(C)C
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Product OPENEYE NAME: methyl 3-[[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]methyl]benzoate
CAS Name: 3-[[4-(2,4-dimethylphenyl)sulfonyl-1-piperazin-1-iumyl]methyl]benzoic acid methyl ester
IUPAC NAME: methyl 3-[[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]methyl]benzoate
SYSTEMATIC NAME: methyl 3-[[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]methyl]benzoate
MOLECULAR FORMULA: C21H27N2O4S+
MOLECULAR WEIGHT: 403.51508
SMILES: CC1=CC(=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC3=CC=CC(=C3)C(=O)OC)C
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