Thursday, September 27, 2012

All Chemical Compounds Information




Product OPENEYE NAME: 5-[2-[benzyl(methyl)amino]ethoxycarbonyl]-2,6-dimethyl-4-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,4-dihydropyridine-3-carboxylic acid
CAS Name: 2,6-dimethyl-5-[2-[methyl-(phenylmethyl)amino]ethoxy-oxomethyl]-4-(2-methyl-3-pyrazolo[1,5-a]pyridinyl)-1,4-dihydropyridine-3-carboxylic acid
IUPAC NAME: 5-[2-[benzyl(methyl)amino]ethoxycarbonyl]-2,6-dimethyl-4-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,4-dihydropyridine-3-carboxylic acid
SYSTEMATIC NAME: 2,6-dimethyl-5-[2-[methyl-(phenylmethyl)amino]ethoxycarbonyl]-4-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,4-dihydropyridine-3-carboxylic acid
MOLECULAR FORMULA: C27H30N4O4
MOLECULAR WEIGHT: 474.5515
SMILES: CC1=C(C(C(=C(N1)C)C(=O)OCCN(C)CC2=CC=CC=C2)C3=C4C=CC=CN4N=C3C)C(=O)O
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Product OPENEYE NAME: 4-tert-butyl-4-(2-isopropylpyrazolo[1,5-a]pyridin-3-yl)-5-methoxycarbonyl-2,6-dimethyl-1H-pyridine-3-carboxylic acid
CAS Name: 4-tert-butyl-5-methoxycarbonyl-2,6-dimethyl-4-(2-propan-2-yl-3-pyrazolo[1,5-a]pyridinyl)-1H-pyridine-3-carboxylic acid
IUPAC NAME: 4-tert-butyl-5-methoxycarbonyl-2,6-dimethyl-4-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)-1H-pyridine-3-carboxylic acid
SYSTEMATIC NAME: 4-tert-butyl-5-methoxycarbonyl-2,6-dimethyl-4-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)-1H-pyridine-3-carboxylic acid
MOLECULAR FORMULA: C24H31N3O4
MOLECULAR WEIGHT: 425.52064
SMILES: CC1=C(C(C(=C(N1)C)C(=O)OC)(C2=C3C=CC=CN3N=C2C(C)C)C(C)(C)C)C(=O)O
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Product OPENEYE NAME: 5-ethoxycarbonyl-4-(2-isopropylpyrazolo[1,5-a]pyridin-3-yl)-2,6-dimethyl-1,4-dihydropyridine-3-carboxylic acid
CAS Name: 5-ethoxycarbonyl-2,6-dimethyl-4-(2-propan-2-yl-3-pyrazolo[1,5-a]pyridinyl)-1,4-dihydropyridine-3-carboxylic acid
IUPAC NAME: 5-ethoxycarbonyl-2,6-dimethyl-4-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)-1,4-dihydropyridine-3-carboxylic acid
SYSTEMATIC NAME: 5-ethoxycarbonyl-2,6-dimethyl-4-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)-1,4-dihydropyridine-3-carboxylic acid
MOLECULAR FORMULA: C21H25N3O4
MOLECULAR WEIGHT: 383.4409
SMILES: CCOC(=O)C1=C(NC(=C(C1C2=C3C=CC=CN3N=C2C(C)C)C(=O)O)C)C
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Product OPENEYE NAME: 7-hydroxy-9a,10-dihydro-9H-acridin-1-one
CAS Name: 7-hydroxy-9a,10-dihydro-9H-acridin-1-one
IUPAC NAME: 7-hydroxy-9a,10-dihydro-9H-acridin-1-one
SYSTEMATIC NAME: 7-oxidanyl-9a,10-dihydro-9H-acridin-1-one
MOLECULAR FORMULA: C13H11NO2
MOLECULAR WEIGHT: 213.23194
SMILES: C1C2C(=O)C=CC=C2NC3=C1C=C(C=C3)O
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Product OPENEYE NAME: (9,9-dimethyl-10H-acridin-2-yl) 2-(p-tolylsulfonylamino)propanoate
CAS Name: 2-[(4-methylphenyl)sulfonylamino]propanoic acid (9,9-dimethyl-10H-acridin-2-yl) ester
IUPAC NAME: (9,9-dimethyl-10H-acridin-2-yl) 2-[(4-methylphenyl)sulfonylamino]propanoate
SYSTEMATIC NAME: (9,9-dimethyl-10H-acridin-2-yl) 2-[(4-methylphenyl)sulfonylamino]propanoate
MOLECULAR FORMULA: C25H26N2O4S
MOLECULAR WEIGHT: 450.54994
SMILES: CC1=CC=C(C=C1)S(=O)(=O)NC(C)C(=O)OC2=CC3=C(C=C2)NC4=CC=CC=C4C3(C)C
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Product OPENEYE NAME: 2-amino-N-[2-oxo-2-[2-oxoethyl(3-sulfanylpropanoyl)amino]ethyl]-3-phenyl-propanamide
CAS Name: 2-amino-N-[2-[(3-mercapto-1-oxopropyl)-(2-oxoethyl)amino]-2-oxoethyl]-3-phenylpropanamide
IUPAC NAME: 2-amino-N-[2-oxo-2-[2-oxoethyl(3-sulfanylpropanoyl)amino]ethyl]-3-phenylpropanamide
SYSTEMATIC NAME: 2-azanyl-N-[2-oxidanylidene-2-[2-oxidanylideneethyl(3-sulfanylpropanoyl)amino]ethyl]-3-phenyl-propanamide
MOLECULAR FORMULA: C16H21N3O4S
MOLECULAR WEIGHT: 351.42064
SMILES: C1=CC=C(C=C1)CC(C(=O)NCC(=O)N(CC=O)C(=O)CCS)N
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Product OPENEYE NAME: 4-[[1-[[1-[[2-[(3-amino-1-formyl-3-oxo-propyl)amino]-2-oxo-1-(sulfanylmethyl)ethyl]carbamoyl]-2-methyl-butyl]carbamoyl]-4-guanidino-butyl]amino]-3-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[(2-amino-3-hydroxy-propanoyl)amino]-3-hydroxy-propanoyl]amino]-3-sulfanyl-propa
CAS Name: 4-[[1-[[1-[[1-[(4-amino-1,4-dioxobutan-2-yl)amino]-3-mercapto-1-oxopropan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-3-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[(2-amino-3-hydroxy-1-oxopropyl)amino]-3-hydroxy-1-oxo
IUPAC NAME: 4-[[1-[[1-[[1-[(4-amino-1,4-dioxobutan-2-yl)amino]-1-oxo-3-sulfanylpropan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-3-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[(2-amino-3-hydroxypropanoyl)amino]-3-hydroxypropanoyl
SYSTEMATIC NAME: 4-[[1-[[1-[[1-[[4-azanyl-1,4-bis(oxidanylidene)butan-2-yl]amino]-1-oxidanylidene-3-sulfanyl-propan-2-yl]amino]-3-methyl-1-oxidanylidene-pentan-2-yl]amino]-5-[bis(azanyl)methylideneamino]-1-oxidanylidene-pentan-2-yl]amino]-3-[[2-[[2-[2-[2-[[2-[[2-[[2-[(2-a
MOLECULAR FORMULA: C57H94N20O18S2
MOLECULAR WEIGHT: 1411.60946
SMILES: CCC(C)C(C(=O)NC(CC(=O)O)C(=O)NC(CCCN=C(N)N)C(=O)NC(C(C)CC)C(=O)NC(CS)C(=O)NC(CC(=O)N)C=O)NC(=O)C(CCCN=C(N)N)NC(=O)CNC(=O)CNC(=O)C(CC1=CC=CC=C1)NC(=O)C(CS)NC(=O)C(CO)NC(=O)C(CO)N
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Product OPENEYE NAME: 1-[(1-methoxycyclohexyl)sulfanylmethyl]-4H-pyridine
CAS Name: 1-[[(1-methoxycyclohexyl)thio]methyl]-4H-pyridine
IUPAC NAME: 1-[(1-methoxycyclohexyl)sulfanylmethyl]-4H-pyridine
SYSTEMATIC NAME: 1-[(1-methoxycyclohexyl)sulfanylmethyl]-4H-pyridine
MOLECULAR FORMULA: C13H21NOS
MOLECULAR WEIGHT: 239.37694
SMILES: COC1(CCCCC1)SCN2C=CCC=C2
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Product OPENEYE NAME: dimethyl 2-(methoxymethylsulfanylmethyl)-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
CAS Name: 2-[(methoxymethylthio)methyl]-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid dimethyl ester
IUPAC NAME: dimethyl 2-(methoxymethylsulfanylmethyl)-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
SYSTEMATIC NAME: dimethyl 2-(methoxymethylsulfanylmethyl)-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
MOLECULAR FORMULA: C19H22N2O7S
MOLECULAR WEIGHT: 422.45218
SMILES: CC1=C(C(C(=C(N1)CSCOC)C(=O)OC)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC
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