Thursday, February 28, 2013

All Chemical Compounds Information




Product OPENEYE NAME: [(1R)-2-(methoxycarbonylamino)-1-methyl-2-oxo-ethyl] 4-benzoylbenzoate
CAS Name: 4-benzoylbenzoic acid [(2R)-1-(methoxycarbonylamino)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2R)-1-(methoxycarbonylamino)-1-oxopropan-2-yl] 4-benzoylbenzoate
SYSTEMATIC NAME: [(2R)-1-(methoxycarbonylamino)-1-oxidanylidene-propan-2-yl] 4-(phenylcarbonyl)benzoate
MOLECULAR FORMULA: C19H17NO6
MOLECULAR WEIGHT: 355.34138
SMILES: C[C@H](C(=O)NC(=O)OC)OC(=O)C1=CC=C(C=C1)C(=O)C2=CC=CC=C2
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Product OPENEYE NAME: [2-(2,3-dimethylanilino)-2-oxo-ethyl] 1-(2-furylmethyl)-2,5-dimethyl-pyrrole-3-carboxylate
CAS Name: 1-(2-furanylmethyl)-2,5-dimethyl-3-pyrrolecarboxylic acid [2-(2,3-dimethylanilino)-2-oxoethyl] ester
IUPAC NAME: [2-(2,3-dimethylanilino)-2-oxoethyl] 1-(furan-2-ylmethyl)-2,5-dimethylpyrrole-3-carboxylate
SYSTEMATIC NAME: [2-[(2,3-dimethylphenyl)amino]-2-oxidanylidene-ethyl] 1-(furan-2-ylmethyl)-2,5-dimethyl-pyrrole-3-carboxylate
MOLECULAR FORMULA: C22H24N2O4
MOLECULAR WEIGHT: 380.43696
SMILES: CC1=C(C(=CC=C1)NC(=O)COC(=O)C2=C(N(C(=C2)C)CC3=CC=CO3)C)C
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Product OPENEYE NAME: [2-oxo-2-(2,2,2-trifluoroethylcarbamoylamino)ethyl] 4-benzoylbenzoate
CAS Name: 4-benzoylbenzoic acid [2-oxo-2-[[oxo-(2,2,2-trifluoroethylamino)methyl]amino]ethyl] ester
IUPAC NAME: [2-oxo-2-(2,2,2-trifluoroethylcarbamoylamino)ethyl] 4-benzoylbenzoate
SYSTEMATIC NAME: [2-oxidanylidene-2-[2,2,2-tris(fluoranyl)ethylcarbamoylamino]ethyl] 4-(phenylcarbonyl)benzoate
MOLECULAR FORMULA: C19H15F3N2O5
MOLECULAR WEIGHT: 408.32801
SMILES: C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)C(=O)OCC(=O)NC(=O)NCC(F)(F)F
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Product OPENEYE NAME: 2-[[2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylacetyl]amino]acetamide
CAS Name: 2-[[2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]-1-oxoethyl]amino]acetamide
IUPAC NAME: 2-[[2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanylacetyl]amino]acetamide
SYSTEMATIC NAME: 2-[2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylethanoylamino]ethanamide
MOLECULAR FORMULA: C15H16N4O2S
MOLECULAR WEIGHT: 316.37814
SMILES: CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC(=O)NCC(=O)N
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Product OPENEYE NAME: [(1S)-1-methyl-2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] 4-benzoylbenzoate
CAS Name: 4-benzoylbenzoic acid [(2S)-1-oxo-1-(2-oxo-1-imidazolidinyl)propan-2-yl] ester
IUPAC NAME: [(2S)-1-oxo-1-(2-oxoimidazolidin-1-yl)propan-2-yl] 4-benzoylbenzoate
SYSTEMATIC NAME: [(2S)-1-oxidanylidene-1-(2-oxidanylideneimidazolidin-1-yl)propan-2-yl] 4-(phenylcarbonyl)benzoate
MOLECULAR FORMULA: C20H18N2O5
MOLECULAR WEIGHT: 366.36732
SMILES: C[C@@H](C(=O)N1CCNC1=O)OC(=O)C2=CC=C(C=C2)C(=O)C3=CC=CC=C3
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Product OPENEYE NAME: [2-(3,4-dimethylanilino)-2-oxo-ethyl] 1-(2-furylmethyl)-2,5-dimethyl-pyrrole-3-carboxylate
CAS Name: 1-(2-furanylmethyl)-2,5-dimethyl-3-pyrrolecarboxylic acid [2-(3,4-dimethylanilino)-2-oxoethyl] ester
IUPAC NAME: [2-(3,4-dimethylanilino)-2-oxoethyl] 1-(furan-2-ylmethyl)-2,5-dimethylpyrrole-3-carboxylate
SYSTEMATIC NAME: [2-[(3,4-dimethylphenyl)amino]-2-oxidanylidene-ethyl] 1-(furan-2-ylmethyl)-2,5-dimethyl-pyrrole-3-carboxylate
MOLECULAR FORMULA: C22H24N2O4
MOLECULAR WEIGHT: 380.43696
SMILES: CC1=C(C=C(C=C1)NC(=O)COC(=O)C2=C(N(C(=C2)C)CC3=CC=CO3)C)C
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Product OPENEYE NAME: N-isopropyl-2-[[2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylacetyl]amino]acetamide
CAS Name: 2-[[2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]-1-oxoethyl]amino]-N-propan-2-ylacetamide
IUPAC NAME: 2-[[2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanylacetyl]amino]-N-propan-2-ylacetamide
SYSTEMATIC NAME: 2-[2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylethanoylamino]-N-propan-2-yl-ethanamide
MOLECULAR FORMULA: C18H22N4O2S
MOLECULAR WEIGHT: 358.45788
SMILES: CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC(=O)NCC(=O)NC(C)C
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Product OPENEYE NAME: N-[(1S)-1-(benzofuran-2-yl)ethyl]-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-acetamide
CAS Name: N-[(1S)-1-(2-benzofuranyl)ethyl]-2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]acetamide
IUPAC NAME: N-[(1S)-1-(1-benzofuran-2-yl)ethyl]-2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanylacetamide
SYSTEMATIC NAME: N-[(1S)-1-(1-benzofuran-2-yl)ethyl]-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-ethanamide
MOLECULAR FORMULA: C23H21N3O2S
MOLECULAR WEIGHT: 403.49674
SMILES: CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC(=O)N[C@@H](C)C3=CC4=CC=CC=C4O3
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Product OPENEYE NAME: [(1R)-1-methyl-2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] 4-benzoylbenzoate
CAS Name: 4-benzoylbenzoic acid [(2R)-1-oxo-1-(2-oxo-1-imidazolidinyl)propan-2-yl] ester
IUPAC NAME: [(2R)-1-oxo-1-(2-oxoimidazolidin-1-yl)propan-2-yl] 4-benzoylbenzoate
SYSTEMATIC NAME: [(2R)-1-oxidanylidene-1-(2-oxidanylideneimidazolidin-1-yl)propan-2-yl] 4-(phenylcarbonyl)benzoate
MOLECULAR FORMULA: C20H18N2O5
MOLECULAR WEIGHT: 366.36732
SMILES: C[C@H](C(=O)N1CCNC1=O)OC(=O)C2=CC=C(C=C2)C(=O)C3=CC=CC=C3
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Product OPENEYE NAME: [(1S)-2-[(1-cyanocyclohexyl)-methyl-amino]-1-methyl-2-oxo-ethyl] 4-benzoylbenzoate
CAS Name: 4-benzoylbenzoic acid [(2S)-1-[(1-cyanocyclohexyl)-methylamino]-1-oxopropan-2-yl] ester
IUPAC NAME: [(2S)-1-[(1-cyanocyclohexyl)-methylamino]-1-oxopropan-2-yl] 4-benzoylbenzoate
SYSTEMATIC NAME: [(2S)-1-[(1-cyanocyclohexyl)-methyl-amino]-1-oxidanylidene-propan-2-yl] 4-(phenylcarbonyl)benzoate
MOLECULAR FORMULA: C25H26N2O4
MOLECULAR WEIGHT: 418.48494
SMILES: C[C@@H](C(=O)N(C)C1(CCCCC1)C#N)OC(=O)C2=CC=C(C=C2)C(=O)C3=CC=CC=C3
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Product OPENEYE NAME: [2-(1-adamantylamino)-2-oxo-ethyl] 1-(2-furylmethyl)-2,5-dimethyl-pyrrole-3-carboxylate
CAS Name: 1-(2-furanylmethyl)-2,5-dimethyl-3-pyrrolecarboxylic acid [2-(1-adamantylamino)-2-oxoethyl] ester
IUPAC NAME: [2-(1-adamantylamino)-2-oxoethyl] 1-(furan-2-ylmethyl)-2,5-dimethylpyrrole-3-carboxylate
SYSTEMATIC NAME: [2-(1-adamantylamino)-2-oxidanylidene-ethyl] 1-(furan-2-ylmethyl)-2,5-dimethyl-pyrrole-3-carboxylate
MOLECULAR FORMULA: C24H30N2O4
MOLECULAR WEIGHT: 410.506
SMILES: CC1=CC(=C(N1CC2=CC=CO2)C)C(=O)OCC(=O)NC34CC5CC(C3)CC(C5)C4
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Product OPENEYE NAME: N-[(1R)-1-(benzofuran-2-yl)ethyl]-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-acetamide
CAS Name: N-[(1R)-1-(2-benzofuranyl)ethyl]-2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]acetamide
IUPAC NAME: N-[(1R)-1-(1-benzofuran-2-yl)ethyl]-2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanylacetamide
SYSTEMATIC NAME: N-[(1R)-1-(1-benzofuran-2-yl)ethyl]-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-ethanamide
MOLECULAR FORMULA: C23H21N3O2S
MOLECULAR WEIGHT: 403.49674
SMILES: CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC(=O)N[C@H](C)C3=CC4=CC=CC=C4O3
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