Monday, February 25, 2013

All Chemical Compounds Information




Product OPENEYE NAME: (2R)-2-(4-bromo-2-fluoro-phenoxy)-N-(2,4-dimethylphenyl)propanamide
CAS Name: (2R)-2-(4-bromo-2-fluorophenoxy)-N-(2,4-dimethylphenyl)propanamide
IUPAC NAME: (2R)-2-(4-bromo-2-fluorophenoxy)-N-(2,4-dimethylphenyl)propanamide
SYSTEMATIC NAME: (2R)-2-(4-bromanyl-2-fluoranyl-phenoxy)-N-(2,4-dimethylphenyl)propanamide
MOLECULAR FORMULA: C17H17BrFNO2
MOLECULAR WEIGHT: 366.224783
SMILES: CC1=CC(=C(C=C1)NC(=O)[C@@H](C)OC2=C(C=C(C=C2)Br)F)C
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Product OPENEYE NAME: [(1R)-2-(4-methoxyphenyl)-1-methyl-2-oxo-ethyl] 6-methyl-4-oxo-chromene-2-carboxylate
CAS Name: 6-methyl-4-oxo-1-benzopyran-2-carboxylic acid [(2R)-1-(4-methoxyphenyl)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2R)-1-(4-methoxyphenyl)-1-oxopropan-2-yl] 6-methyl-4-oxochromene-2-carboxylate
SYSTEMATIC NAME: [(2R)-1-(4-methoxyphenyl)-1-oxidanylidene-propan-2-yl] 6-methyl-4-oxidanylidene-chromene-2-carboxylate
MOLECULAR FORMULA: C21H18O6
MOLECULAR WEIGHT: 366.36402
SMILES: CC1=CC2=C(C=C1)OC(=CC2=O)C(=O)O[C@H](C)C(=O)C3=CC=C(C=C3)OC
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Product OPENEYE NAME: (2S)-2-(4-bromo-2-fluoro-phenoxy)-N-(2,4-dimethylphenyl)propanamide
CAS Name: (2S)-2-(4-bromo-2-fluorophenoxy)-N-(2,4-dimethylphenyl)propanamide
IUPAC NAME: (2S)-2-(4-bromo-2-fluorophenoxy)-N-(2,4-dimethylphenyl)propanamide
SYSTEMATIC NAME: (2S)-2-(4-bromanyl-2-fluoranyl-phenoxy)-N-(2,4-dimethylphenyl)propanamide
MOLECULAR FORMULA: C17H17BrFNO2
MOLECULAR WEIGHT: 366.224783
SMILES: CC1=CC(=C(C=C1)NC(=O)[C@H](C)OC2=C(C=C(C=C2)Br)F)C
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Product OPENEYE NAME: benzhydryl-[2-(2,6-dichloro-3-methyl-anilino)-2-oxo-ethyl]-methyl-ammonium
CAS Name: [2-(2,6-dichloro-3-methylanilino)-2-oxoethyl]-(diphenylmethyl)-methylammonium
IUPAC NAME: benzhydryl-[2-(2,6-dichloro-3-methylanilino)-2-oxoethyl]-methylazanium
SYSTEMATIC NAME: [2-[[2,6-bis(chloranyl)-3-methyl-phenyl]amino]-2-oxidanylidene-ethyl]-(diphenylmethyl)-methyl-azanium
MOLECULAR FORMULA: C23H23Cl2N2O+
MOLECULAR WEIGHT: 414.34752
SMILES: CC1=C(C(=C(C=C1)Cl)NC(=O)C[NH+](C)C(C2=CC=CC=C2)C3=CC=CC=C3)Cl
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Product OPENEYE NAME: 2-[benzhydryl(methyl)amino]-N-(2,6-dichloro-3-methyl-phenyl)acetamide
CAS Name: N-(2,6-dichloro-3-methylphenyl)-2-[(diphenylmethyl)-methylamino]acetamide
IUPAC NAME: 2-[benzhydryl(methyl)amino]-N-(2,6-dichloro-3-methylphenyl)acetamide
SYSTEMATIC NAME: N-[2,6-bis(chloranyl)-3-methyl-phenyl]-2-[(diphenylmethyl)-methyl-amino]ethanamide
MOLECULAR FORMULA: C23H22Cl2N2O
MOLECULAR WEIGHT: 413.33958
SMILES: CC1=C(C(=C(C=C1)Cl)NC(=O)CN(C)C(C2=CC=CC=C2)C3=CC=CC=C3)Cl
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Product OPENEYE NAME: 2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-N-[(1R)-tetralin-1-yl]acetamide
CAS Name: 2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide
IUPAC NAME: 2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide
SYSTEMATIC NAME: 2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]ethanamide
MOLECULAR FORMULA: C23H23N3OS
MOLECULAR WEIGHT: 389.51322
SMILES: CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC(=O)N[C@@H]3CCCC4=CC=CC=C34
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Product OPENEYE NAME: [(1S)-1-methyl-2-(2-nitroanilino)-2-oxo-ethyl] 6-methyl-4-oxo-chromene-2-carboxylate
CAS Name: 6-methyl-4-oxo-1-benzopyran-2-carboxylic acid [(2S)-1-(2-nitroanilino)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2S)-1-(2-nitroanilino)-1-oxopropan-2-yl] 6-methyl-4-oxochromene-2-carboxylate
SYSTEMATIC NAME: [(2S)-1-[(2-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl] 6-methyl-4-oxidanylidene-chromene-2-carboxylate
MOLECULAR FORMULA: C20H16N2O7
MOLECULAR WEIGHT: 396.35024
SMILES: CC1=CC2=C(C=C1)OC(=CC2=O)C(=O)O[C@@H](C)C(=O)NC3=CC=CC=C3[N+](=O)[O-]
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Product OPENEYE NAME: 1-(2-methylallyl)-3-[[2-(4-methyl-2-oxo-chromen-7-yl)oxyacetyl]amino]thiourea
CAS Name: 1-[[2-[(4-methyl-2-oxo-1-benzopyran-7-yl)oxy]-1-oxoethyl]amino]-3-(2-methylprop-2-enyl)thiourea
IUPAC NAME: 1-[[2-(4-methyl-2-oxochromen-7-yl)oxyacetyl]amino]-3-(2-methylprop-2-enyl)thiourea
SYSTEMATIC NAME: 1-[2-(4-methyl-2-oxidanylidene-chromen-7-yl)oxyethanoylamino]-3-(2-methylprop-2-enyl)thiourea
MOLECULAR FORMULA: C17H19N3O4S
MOLECULAR WEIGHT: 361.41546
SMILES: CC1=CC(=O)OC2=C1C=CC(=C2)OCC(=O)NNC(=S)NCC(=C)C
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Product OPENEYE NAME: (2S)-2-(4-bromo-2-fluoro-phenoxy)-N-(3-fluorophenyl)propanamide
CAS Name: (2S)-2-(4-bromo-2-fluorophenoxy)-N-(3-fluorophenyl)propanamide
IUPAC NAME: (2S)-2-(4-bromo-2-fluorophenoxy)-N-(3-fluorophenyl)propanamide
SYSTEMATIC NAME: (2S)-2-(4-bromanyl-2-fluoranyl-phenoxy)-N-(3-fluorophenyl)propanamide
MOLECULAR FORMULA: C15H12BrF2NO2
MOLECULAR WEIGHT: 356.162086
SMILES: C[C@@H](C(=O)NC1=CC(=CC=C1)F)OC2=C(C=C(C=C2)Br)F
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Product OPENEYE NAME: benzhydryl-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxo-ethyl]-methyl-ammonium
CAS Name: [2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl]-(diphenylmethyl)-methylammonium
IUPAC NAME: benzhydryl-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl]-methylazanium
SYSTEMATIC NAME: [2-(1,3-benzodioxol-5-ylmethylamino)-2-oxidanylidene-ethyl]-(diphenylmethyl)-methyl-azanium
MOLECULAR FORMULA: C24H25N2O3+
MOLECULAR WEIGHT: 389.4669
SMILES: C[NH+](CC(=O)NCC1=CC2=C(C=C1)OCO2)C(C3=CC=CC=C3)C4=CC=CC=C4
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Product OPENEYE NAME: 2-[benzhydryl(methyl)amino]-N-(1,3-benzodioxol-5-ylmethyl)acetamide
CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(diphenylmethyl)-methylamino]acetamide
IUPAC NAME: 2-[benzhydryl(methyl)amino]-N-(1,3-benzodioxol-5-ylmethyl)acetamide
SYSTEMATIC NAME: N-(1,3-benzodioxol-5-ylmethyl)-2-[(diphenylmethyl)-methyl-amino]ethanamide
MOLECULAR FORMULA: C24H24N2O3
MOLECULAR WEIGHT: 388.45896
SMILES: CN(CC(=O)NCC1=CC2=C(C=C1)OCO2)C(C3=CC=CC=C3)C4=CC=CC=C4
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Product OPENEYE NAME: (2R)-2-(4-bromo-2-fluoro-phenoxy)-N-(3-fluorophenyl)propanamide
CAS Name: (2R)-2-(4-bromo-2-fluorophenoxy)-N-(3-fluorophenyl)propanamide
IUPAC NAME: (2R)-2-(4-bromo-2-fluorophenoxy)-N-(3-fluorophenyl)propanamide
SYSTEMATIC NAME: (2R)-2-(4-bromanyl-2-fluoranyl-phenoxy)-N-(3-fluorophenyl)propanamide
MOLECULAR FORMULA: C15H12BrF2NO2
MOLECULAR WEIGHT: 356.162086
SMILES: C[C@H](C(=O)NC1=CC(=CC=C1)F)OC2=C(C=C(C=C2)Br)F
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Product OPENEYE NAME: [(1R)-1-methyl-2-(2-nitroanilino)-2-oxo-ethyl] 6-methyl-4-oxo-chromene-2-carboxylate
CAS Name: 6-methyl-4-oxo-1-benzopyran-2-carboxylic acid [(2R)-1-(2-nitroanilino)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2R)-1-(2-nitroanilino)-1-oxopropan-2-yl] 6-methyl-4-oxochromene-2-carboxylate
SYSTEMATIC NAME: [(2R)-1-[(2-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl] 6-methyl-4-oxidanylidene-chromene-2-carboxylate
MOLECULAR FORMULA: C20H16N2O7
MOLECULAR WEIGHT: 396.35024
SMILES: CC1=CC2=C(C=C1)OC(=CC2=O)C(=O)O[C@H](C)C(=O)NC3=CC=CC=C3[N+](=O)[O-]
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Product OPENEYE NAME: 2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-N-[(1S)-tetralin-1-yl]acetamide
CAS Name: 2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide
IUPAC NAME: 2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanyl-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide
SYSTEMATIC NAME: 2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]ethanamide
MOLECULAR FORMULA: C23H23N3OS
MOLECULAR WEIGHT: 389.51322
SMILES: CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC(=O)N[C@H]3CCCC4=CC=CC=C34
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Product OPENEYE NAME: benzhydryl-[2-(2-isopropylanilino)-2-oxo-ethyl]-methyl-ammonium
CAS Name: (diphenylmethyl)-methyl-[2-oxo-2-(2-propan-2-ylanilino)ethyl]ammonium
IUPAC NAME: benzhydryl-methyl-[2-oxo-2-(2-propan-2-ylanilino)ethyl]azanium
SYSTEMATIC NAME: (diphenylmethyl)-methyl-[2-oxidanylidene-2-[(2-propan-2-ylphenyl)amino]ethyl]azanium
MOLECULAR FORMULA: C25H29N2O+
MOLECULAR WEIGHT: 373.51056
SMILES: CC(C)C1=CC=CC=C1NC(=O)C[NH+](C)C(C2=CC=CC=C2)C3=CC=CC=C3
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