Saturday, March 2, 2013

All Chemical Compounds Information




Product OPENEYE NAME: [(1R)-1-methyl-2-oxo-2-pyrrolidin-1-yl-ethyl] 2-[(2-methylthiazol-4-yl)methoxy]benzoate
CAS Name: 2-[(2-methyl-4-thiazolyl)methoxy]benzoic acid [(2R)-1-oxo-1-(1-pyrrolidinyl)propan-2-yl] ester
IUPAC NAME: [(2R)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl] 2-[(2-methyl-1,3-thiazol-4-yl)methoxy]benzoate
SYSTEMATIC NAME: [(2R)-1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl] 2-[(2-methyl-1,3-thiazol-4-yl)methoxy]benzoate
MOLECULAR FORMULA: C19H22N2O4S
MOLECULAR WEIGHT: 374.45398
SMILES: CC1=NC(=CS1)COC2=CC=CC=C2C(=O)O[C@H](C)C(=O)N3CCCC3
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Product OPENEYE NAME: (7-hydroxy-2-oxo-chromen-4-yl)methyl 1-(2-furylmethyl)-2,5-dimethyl-pyrrole-3-carboxylate
CAS Name: 1-(2-furanylmethyl)-2,5-dimethyl-3-pyrrolecarboxylic acid (7-hydroxy-2-oxo-1-benzopyran-4-yl)methyl ester
IUPAC NAME: (7-hydroxy-2-oxochromen-4-yl)methyl 1-(furan-2-ylmethyl)-2,5-dimethylpyrrole-3-carboxylate
SYSTEMATIC NAME: (7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 1-(furan-2-ylmethyl)-2,5-dimethyl-pyrrole-3-carboxylate
MOLECULAR FORMULA: C22H19NO6
MOLECULAR WEIGHT: 393.38936
SMILES: CC1=CC(=C(N1CC2=CC=CO2)C)C(=O)OCC3=CC(=O)OC4=C3C=CC(=C4)O
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Product OPENEYE NAME: [2-[(4-methylcyclohexyl)amino]-2-oxo-ethyl] 2-[(2-methylthiazol-4-yl)methoxy]benzoate
CAS Name: 2-[(2-methyl-4-thiazolyl)methoxy]benzoic acid [2-[(4-methylcyclohexyl)amino]-2-oxoethyl] ester
IUPAC NAME: [2-[(4-methylcyclohexyl)amino]-2-oxoethyl] 2-[(2-methyl-1,3-thiazol-4-yl)methoxy]benzoate
SYSTEMATIC NAME: [2-[(4-methylcyclohexyl)amino]-2-oxidanylidene-ethyl] 2-[(2-methyl-1,3-thiazol-4-yl)methoxy]benzoate
MOLECULAR FORMULA: C21H26N2O4S
MOLECULAR WEIGHT: 402.50714
SMILES: CC1CCC(CC1)NC(=O)COC(=O)C2=CC=CC=C2OCC3=CSC(=N3)C
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Product OPENEYE NAME: [(1S)-2-[(4-fluorophenyl)methylamino]-1-methyl-2-oxo-ethyl] 5-nitrobenzothiophene-2-carboxylate
CAS Name: 5-nitro-1-benzothiophene-2-carboxylic acid [(2S)-1-[(4-fluorophenyl)methylamino]-1-oxopropan-2-yl] ester
IUPAC NAME: [(2S)-1-[(4-fluorophenyl)methylamino]-1-oxopropan-2-yl] 5-nitro-1-benzothiophene-2-carboxylate
SYSTEMATIC NAME: [(2S)-1-[(4-fluorophenyl)methylamino]-1-oxidanylidene-propan-2-yl] 5-nitro-1-benzothiophene-2-carboxylate
MOLECULAR FORMULA: C19H15FN2O5S
MOLECULAR WEIGHT: 402.396203
SMILES: C[C@@H](C(=O)NCC1=CC=C(C=C1)F)OC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-]
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Product OPENEYE NAME: [(1R)-1-methyl-2-(3-methylanilino)-2-oxo-ethyl] 1-(2-furylmethyl)-2,5-dimethyl-pyrrole-3-carboxylate
CAS Name: 1-(2-furanylmethyl)-2,5-dimethyl-3-pyrrolecarboxylic acid [(2R)-1-(3-methylanilino)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2R)-1-(3-methylanilino)-1-oxopropan-2-yl] 1-(furan-2-ylmethyl)-2,5-dimethylpyrrole-3-carboxylate
SYSTEMATIC NAME: [(2R)-1-[(3-methylphenyl)amino]-1-oxidanylidene-propan-2-yl] 1-(furan-2-ylmethyl)-2,5-dimethyl-pyrrole-3-carboxylate
MOLECULAR FORMULA: C22H24N2O4
MOLECULAR WEIGHT: 380.43696
SMILES: CC1=CC(=CC=C1)NC(=O)[C@@H](C)OC(=O)C2=C(N(C(=C2)C)CC3=CC=CO3)C
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Product OPENEYE NAME: o-tolylmethyl 2-[(2-methylthiazol-4-yl)methoxy]benzoate
CAS Name: 2-[(2-methyl-4-thiazolyl)methoxy]benzoic acid (2-methylphenyl)methyl ester
IUPAC NAME: (2-methylphenyl)methyl 2-[(2-methyl-1,3-thiazol-4-yl)methoxy]benzoate
SYSTEMATIC NAME: (2-methylphenyl)methyl 2-[(2-methyl-1,3-thiazol-4-yl)methoxy]benzoate
MOLECULAR FORMULA: C20H19NO3S
MOLECULAR WEIGHT: 353.43476
SMILES: CC1=CC=CC=C1COC(=O)C2=CC=CC=C2OCC3=CSC(=N3)C
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Product OPENEYE NAME: [(1R)-2-[(4-fluorophenyl)methylamino]-1-methyl-2-oxo-ethyl] 5-nitrobenzothiophene-2-carboxylate
CAS Name: 5-nitro-1-benzothiophene-2-carboxylic acid [(2R)-1-[(4-fluorophenyl)methylamino]-1-oxopropan-2-yl] ester
IUPAC NAME: [(2R)-1-[(4-fluorophenyl)methylamino]-1-oxopropan-2-yl] 5-nitro-1-benzothiophene-2-carboxylate
SYSTEMATIC NAME: [(2R)-1-[(4-fluorophenyl)methylamino]-1-oxidanylidene-propan-2-yl] 5-nitro-1-benzothiophene-2-carboxylate
MOLECULAR FORMULA: C19H15FN2O5S
MOLECULAR WEIGHT: 402.396203
SMILES: C[C@H](C(=O)NCC1=CC=C(C=C1)F)OC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-]
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Product OPENEYE NAME: [(1S)-1-methyl-2-(3-methylanilino)-2-oxo-ethyl] 1-(2-furylmethyl)-2,5-dimethyl-pyrrole-3-carboxylate
CAS Name: 1-(2-furanylmethyl)-2,5-dimethyl-3-pyrrolecarboxylic acid [(2S)-1-(3-methylanilino)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2S)-1-(3-methylanilino)-1-oxopropan-2-yl] 1-(furan-2-ylmethyl)-2,5-dimethylpyrrole-3-carboxylate
SYSTEMATIC NAME: [(2S)-1-[(3-methylphenyl)amino]-1-oxidanylidene-propan-2-yl] 1-(furan-2-ylmethyl)-2,5-dimethyl-pyrrole-3-carboxylate
MOLECULAR FORMULA: C22H24N2O4
MOLECULAR WEIGHT: 380.43696
SMILES: CC1=CC(=CC=C1)NC(=O)[C@H](C)OC(=O)C2=C(N(C(=C2)C)CC3=CC=CO3)C
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Product OPENEYE NAME: [(1S)-1-methyl-2-oxo-2-ureido-ethyl] 2-[(2-methylthiazol-4-yl)methoxy]benzoate
CAS Name: 2-[(2-methyl-4-thiazolyl)methoxy]benzoic acid [(2S)-1-(carbamoylamino)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2S)-1-(carbamoylamino)-1-oxopropan-2-yl] 2-[(2-methyl-1,3-thiazol-4-yl)methoxy]benzoate
SYSTEMATIC NAME: [(2S)-1-(aminocarbonylamino)-1-oxidanylidene-propan-2-yl] 2-[(2-methyl-1,3-thiazol-4-yl)methoxy]benzoate
MOLECULAR FORMULA: C16H17N3O5S
MOLECULAR WEIGHT: 363.38828
SMILES: CC1=NC(=CS1)COC2=CC=CC=C2C(=O)O[C@@H](C)C(=O)NC(=O)N
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