Friday, September 28, 2012

All Chemical Compounds Information




Product OPENEYE NAME: (4-nitrophenyl)methyl 4-acetylsulfanyl-2-ethyl-3-thiazol-5-yl-pyrrolidine-1-carboxylate; (4-nitrophenyl)methyl carbamate
CAS Name: 4-(acetylthio)-2-ethyl-3-(5-thiazolyl)-1-pyrrolidinecarboxylic acid (4-nitrophenyl)methyl ester; carbamic acid (4-nitrophenyl)methyl ester
IUPAC NAME: (4-nitrophenyl)methyl 4-acetylsulfanyl-2-ethyl-3-(1,3-thiazol-5-yl)pyrrolidine-1-carboxylate; (4-nitrophenyl)methyl carbamate
SYSTEMATIC NAME: (4-nitrophenyl)methyl carbamate; (4-nitrophenyl)methyl 4-ethanoylsulfanyl-2-ethyl-3-(1,3-thiazol-5-yl)pyrrolidine-1-carboxylate
MOLECULAR FORMULA: C27H29N5O9S2
MOLECULAR WEIGHT: 631.67726
SMILES: CCC1C(C(CN1C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])SC(=O)C)C3=CN=CS3.C1=CC(=CC=C1COC(=O)N)[N+](=O)[O-]
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Product OPENEYE NAME: (4-nitrophenyl)methyl 4-acetylsulfanyl-2-ethyl-3-thiazol-5-yl-pyrrolidine-1-carboxylate
CAS Name: 4-(acetylthio)-2-ethyl-3-(5-thiazolyl)-1-pyrrolidinecarboxylic acid (4-nitrophenyl)methyl ester
IUPAC NAME: (4-nitrophenyl)methyl 4-acetylsulfanyl-2-ethyl-3-(1,3-thiazol-5-yl)pyrrolidine-1-carboxylate
SYSTEMATIC NAME: (4-nitrophenyl)methyl 4-ethanoylsulfanyl-2-ethyl-3-(1,3-thiazol-5-yl)pyrrolidine-1-carboxylate
MOLECULAR FORMULA: C19H21N3O5S2
MOLECULAR WEIGHT: 435.51714
SMILES: CCC1C(C(CN1C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])SC(=O)C)C3=CN=CS3
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Product OPENEYE NAME: (4-nitrophenyl)methyl 2-(1,3-dithian-2-yl)pyrrolidine-1-carboxylate
CAS Name: 2-(1,3-dithian-2-yl)-1-pyrrolidinecarboxylic acid (4-nitrophenyl)methyl ester
IUPAC NAME: (4-nitrophenyl)methyl 2-(1,3-dithian-2-yl)pyrrolidine-1-carboxylate
SYSTEMATIC NAME: (4-nitrophenyl)methyl 2-(1,3-dithian-2-yl)pyrrolidine-1-carboxylate
MOLECULAR FORMULA: C16H20N2O4S2
MOLECULAR WEIGHT: 368.471
SMILES: C1CC(N(C1)C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])C3SCCCS3
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Product OPENEYE NAME: (4-nitrophenyl)methyl 2-(4-carbamoylthiazol-2-yl)pyrrolidine-1-carboxylate
CAS Name: 2-(4-carbamoyl-2-thiazolyl)-1-pyrrolidinecarboxylic acid (4-nitrophenyl)methyl ester
IUPAC NAME: (4-nitrophenyl)methyl 2-(4-carbamoyl-1,3-thiazol-2-yl)pyrrolidine-1-carboxylate
SYSTEMATIC NAME: (4-nitrophenyl)methyl 2-(4-aminocarbonyl-1,3-thiazol-2-yl)pyrrolidine-1-carboxylate
MOLECULAR FORMULA: C16H16N4O5S
MOLECULAR WEIGHT: 376.38704
SMILES: C1CC(N(C1)C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])C3=NC(=CS3)C(=O)N
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Product OPENEYE NAME: [(4-nitrophenyl)methoxycarbonylamino] propanoate
CAS Name: propanoic acid [[(4-nitrophenyl)methoxy-oxomethyl]amino] ester
IUPAC NAME: [(4-nitrophenyl)methoxycarbonylamino] propanoate
SYSTEMATIC NAME: [(4-nitrophenyl)methoxycarbonylamino] propanoate
MOLECULAR FORMULA: C11H12N2O6
MOLECULAR WEIGHT: 268.22278
SMILES: CCC(=O)ONC(=O)OCC1=CC=C(C=C1)[N+](=O)[O-]
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Product OPENEYE NAME: (4-nitrophenyl)methyl 2-[2-hydroxy-1-[(4-nitrophenyl)methoxycarbonyl]pyrrolidin-2-yl]-4,5-dihydroimidazole-1-carboxylate
CAS Name: 2-[2-hydroxy-1-[(4-nitrophenyl)methoxy-oxomethyl]-2-pyrrolidinyl]-4,5-dihydroimidazole-1-carboxylic acid (4-nitrophenyl)methyl ester
IUPAC NAME: (4-nitrophenyl)methyl 2-[2-hydroxy-1-[(4-nitrophenyl)methoxycarbonyl]pyrrolidin-2-yl]-4,5-dihydroimidazole-1-carboxylate
SYSTEMATIC NAME: (4-nitrophenyl)methyl 2-[1-[(4-nitrophenyl)methoxycarbonyl]-2-oxidanyl-pyrrolidin-2-yl]-4,5-dihydroimidazole-1-carboxylate
MOLECULAR FORMULA: C23H23N5O9
MOLECULAR WEIGHT: 513.45682
SMILES: C1CC(N(C1)C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])(C3=NCCN3C(=O)OCC4=CC=C(C=C4)[N+](=O)[O-])O
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Product OPENEYE NAME: (4-nitrophenyl)methyl 2-(1,3-dioxolan-2-yl)pyrrolidine-1-carboxylate
CAS Name: 2-(1,3-dioxolan-2-yl)-1-pyrrolidinecarboxylic acid (4-nitrophenyl)methyl ester
IUPAC NAME: (4-nitrophenyl)methyl 2-(1,3-dioxolan-2-yl)pyrrolidine-1-carboxylate
SYSTEMATIC NAME: (4-nitrophenyl)methyl 2-(1,3-dioxolan-2-yl)pyrrolidine-1-carboxylate
MOLECULAR FORMULA: C15H18N2O6
MOLECULAR WEIGHT: 322.31322
SMILES: C1CC(N(C1)C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])C3OCCO3
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Product OPENEYE NAME: (4-nitrophenyl)methyl 2-[5-(methylamino)-1,3,4-thiadiazol-2-yl]pyrrolidine-1-carboxylate
CAS Name: 2-[5-(methylamino)-1,3,4-thiadiazol-2-yl]-1-pyrrolidinecarboxylic acid (4-nitrophenyl)methyl ester
IUPAC NAME: (4-nitrophenyl)methyl 2-[5-(methylamino)-1,3,4-thiadiazol-2-yl]pyrrolidine-1-carboxylate
SYSTEMATIC NAME: (4-nitrophenyl)methyl 2-[5-(methylamino)-1,3,4-thiadiazol-2-yl]pyrrolidine-1-carboxylate
MOLECULAR FORMULA: C15H17N5O4S
MOLECULAR WEIGHT: 363.39158
SMILES: CNC1=NN=C(S1)C2CCCN2C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-]
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Product OPENEYE NAME: [[nitro(phenyl)methoxy]carbonylamino] propanoate
CAS Name: propanoic acid [[[nitro(phenyl)methoxy]-oxomethyl]amino] ester
IUPAC NAME: [[nitro(phenyl)methoxy]carbonylamino] propanoate
SYSTEMATIC NAME: [[nitro(phenyl)methoxy]carbonylamino] propanoate
MOLECULAR FORMULA: C11H12N2O6
MOLECULAR WEIGHT: 268.22278
SMILES: CCC(=O)ONC(=O)OC(C1=CC=CC=C1)[N+](=O)[O-]
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Product OPENEYE NAME: 5-pyrrolidin-1-yl-1H-1,2,4-triazole
CAS Name: 5-(1-pyrrolidinyl)-1H-1,2,4-triazole
IUPAC NAME: 5-pyrrolidin-1-yl-1H-1,2,4-triazole
SYSTEMATIC NAME: 5-pyrrolidin-1-yl-1H-1,2,4-triazole
MOLECULAR FORMULA: C6H10N4
MOLECULAR WEIGHT: 138.1704
SMILES: C1CCN(C1)C2=NC=NN2
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Product OPENEYE NAME: (4-nitrophenyl)methyl 2-acetylsulfanyl-2-[5-[(4-nitrophenyl)methoxycarbonylamino]-1,3-dioxan-2-yl]pyrrolidine-1-carboxylate
CAS Name: 2-(acetylthio)-2-[5-[[(4-nitrophenyl)methoxy-oxomethyl]amino]-1,3-dioxan-2-yl]-1-pyrrolidinecarboxylic acid (4-nitrophenyl)methyl ester
IUPAC NAME: (4-nitrophenyl)methyl 2-acetylsulfanyl-2-[5-[(4-nitrophenyl)methoxycarbonylamino]-1,3-dioxan-2-yl]pyrrolidine-1-carboxylate
SYSTEMATIC NAME: (4-nitrophenyl)methyl 2-ethanoylsulfanyl-2-[5-[(4-nitrophenyl)methoxycarbonylamino]-1,3-dioxan-2-yl]pyrrolidine-1-carboxylate
MOLECULAR FORMULA: C26H28N4O11S
MOLECULAR WEIGHT: 604.58572
SMILES: CC(=O)SC1(CCCN1C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])C3OCC(CO3)NC(=O)OCC4=CC=C(C=C4)[N+](=O)[O-]
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Product OPENEYE NAME: (4-nitrophenyl)methyl N-(thiazol-2-ylmethyl)carbamate
CAS Name: N-(2-thiazolylmethyl)carbamic acid (4-nitrophenyl)methyl ester
IUPAC NAME: (4-nitrophenyl)methyl N-(1,3-thiazol-2-ylmethyl)carbamate
SYSTEMATIC NAME: (4-nitrophenyl)methyl N-(1,3-thiazol-2-ylmethyl)carbamate
MOLECULAR FORMULA: C12H11N3O4S
MOLECULAR WEIGHT: 293.29844
SMILES: C1=CC(=CC=C1COC(=O)NCC2=NC=CS2)[N+](=O)[O-]
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Product OPENEYE NAME: (4-nitrophenyl)methyl 2-thiazol-4-ylpyrrolidine-1-carboxylate
CAS Name: 2-(4-thiazolyl)-1-pyrrolidinecarboxylic acid (4-nitrophenyl)methyl ester
IUPAC NAME: (4-nitrophenyl)methyl 2-(1,3-thiazol-4-yl)pyrrolidine-1-carboxylate
SYSTEMATIC NAME: (4-nitrophenyl)methyl 2-(1,3-thiazol-4-yl)pyrrolidine-1-carboxylate
MOLECULAR FORMULA: C15H15N3O4S
MOLECULAR WEIGHT: 333.3623
SMILES: C1CC(N(C1)C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])C3=CSC=N3
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Product OPENEYE NAME: 3-benzyloxycarbonyl-4-methylsulfonyloxy-1H-pyrrole-2-carboxylic acid
CAS Name: 4-methylsulfonyloxy-3-phenylmethoxycarbonyl-1H-pyrrole-2-carboxylic acid
IUPAC NAME: 4-methylsulfonyloxy-3-phenylmethoxycarbonyl-1H-pyrrole-2-carboxylic acid
SYSTEMATIC NAME: 4-methylsulfonyloxy-3-phenylmethoxycarbonyl-1H-pyrrole-2-carboxylic acid
MOLECULAR FORMULA: C14H13NO7S
MOLECULAR WEIGHT: 339.32052
SMILES: CS(=O)(=O)OC1=CNC(=C1C(=O)OCC2=CC=CC=C2)C(=O)O
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Product OPENEYE NAME: butyl 4-[tert-butyl(dimethyl)silyl]oxy-2-(hydroxymethyl)pyrrolidine-1-carboxylate
CAS Name: 4-[tert-butyl(dimethyl)silyl]oxy-2-(hydroxymethyl)-1-pyrrolidinecarboxylic acid butyl ester
IUPAC NAME: butyl 4-[tert-butyl(dimethyl)silyl]oxy-2-(hydroxymethyl)pyrrolidine-1-carboxylate
SYSTEMATIC NAME: butyl 4-[tert-butyl(dimethyl)silyl]oxy-2-(hydroxymethyl)pyrrolidine-1-carboxylate
MOLECULAR FORMULA: C16H33NO4Si
MOLECULAR WEIGHT: 331.52302
SMILES: CCCCOC(=O)N1CC(CC1CO)O[Si](C)(C)C(C)(C)C
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