Thursday, June 27, 2013

All Chemical Compounds Information




Product OPENEYE NAME: (carboxyamino)-(2-pyridylsulfanyl)carbamic acid
CAS Name: (carboxyamino)-(2-pyridinylthio)carbamic acid
IUPAC NAME: (carboxyamino)-pyridin-2-ylsulfanylcarbamic acid
SYSTEMATIC NAME: (carboxyamino)-pyridin-2-ylsulfanyl-carbamic acid
MOLECULAR FORMULA: C7H7N3O4S
MOLECULAR WEIGHT: 229.21318
SMILES: C1=CC=NC(=C1)SN(C(=O)O)NC(=O)O
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Product OPENEYE NAME: 2-(disulfanyl)-1-oxido-pyridin-1-ium
CAS Name: 2-(disulfanyl)-1-oxidopyridin-1-ium
IUPAC NAME: 2-(disulfanyl)-1-oxidopyridin-1-ium
SYSTEMATIC NAME: 2-(disulfanyl)-1-oxidanidyl-pyridin-1-ium
MOLECULAR FORMULA: C5H5NOS2
MOLECULAR WEIGHT: 159.2293
SMILES: C1=CC=[N+](C(=C1)SS)[O-]
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Product OPENEYE NAME: ethyl N-(ethoxycarbonylamino)-N-[(4-phenyl-2-pyridyl)sulfanyl]carbamate
CAS Name: N-(ethoxycarbonylamino)-N-[(4-phenyl-2-pyridinyl)thio]carbamic acid ethyl ester
IUPAC NAME: ethyl N-(ethoxycarbonylamino)-N-(4-phenylpyridin-2-yl)sulfanylcarbamate
SYSTEMATIC NAME: ethyl N-(ethoxycarbonylamino)-N-(4-phenylpyridin-2-yl)sulfanyl-carbamate
MOLECULAR FORMULA: C17H19N3O4S
MOLECULAR WEIGHT: 361.41546
SMILES: CCOC(=O)NN(C(=O)OCC)SC1=NC=CC(=C1)C2=CC=CC=C2
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Product OPENEYE NAME: (3Z,7Z)-3-[2-[bis(benzyloxycarbonyl)amino]ethylidene]-7-(2-methoxy-2-oxo-ethylidene)-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylate
CAS Name: (3Z,7Z)-3-[2-[bis(phenylmethoxycarbonyl)amino]ethylidene]-7-(2-methoxy-2-oxoethylidene)-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylate
IUPAC NAME: (3Z,7Z)-3-[2-[bis(phenylmethoxycarbonyl)amino]ethylidene]-7-(2-methoxy-2-oxoethylidene)-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylate
SYSTEMATIC NAME: (3Z,7Z)-3-[2-[bis(phenylmethoxycarbonyl)amino]ethylidene]-7-(2-methoxy-2-oxidanylidene-ethylidene)-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylate
MOLECULAR FORMULA: C27H25N2O9-
MOLECULAR WEIGHT: 521.4954
SMILES: COC(=O)/C=C\1/CC2N1C(/C(=C/CN(C(=O)OCC3=CC=CC=C3)C(=O)OCC4=CC=CC=C4)/O2)C(=O)[O-]
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Product OPENEYE NAME: (3Z,7Z)-3-[2-[bis(benzyloxycarbonyl)amino]ethylidene]-7-(2-methoxy-2-oxo-ethylidene)-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
CAS Name: (3Z,7Z)-3-[2-[bis(phenylmethoxycarbonyl)amino]ethylidene]-7-(2-methoxy-2-oxoethylidene)-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
IUPAC NAME: (3Z,7Z)-3-[2-[bis(phenylmethoxycarbonyl)amino]ethylidene]-7-(2-methoxy-2-oxoethylidene)-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
SYSTEMATIC NAME: (3Z,7Z)-3-[2-[bis(phenylmethoxycarbonyl)amino]ethylidene]-7-(2-methoxy-2-oxidanylidene-ethylidene)-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
MOLECULAR FORMULA: C27H26N2O9
MOLECULAR WEIGHT: 522.50334
SMILES: COC(=O)/C=C\1/CC2N1C(/C(=C/CN(C(=O)OCC3=CC=CC=C3)C(=O)OCC4=CC=CC=C4)/O2)C(=O)O
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Product OPENEYE NAME: (7E)-6-(benzylideneamino)-7-(2-methoxy-2-oxo-ethylidene)-3,3-dimethyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
CAS Name: (7E)-7-(2-methoxy-2-oxoethylidene)-3,3-dimethyl-6-[(phenylmethylene)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
IUPAC NAME: (7E)-6-(benzylideneamino)-7-(2-methoxy-2-oxoethylidene)-3,3-dimethyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
SYSTEMATIC NAME: (7E)-7-(2-methoxy-2-oxidanylidene-ethylidene)-3,3-dimethyl-6-[(phenylmethylidene)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
MOLECULAR FORMULA: C18H19N2O4S-
MOLECULAR WEIGHT: 359.41946
SMILES: CC1(C(N\2C(S1)C(/C2=C\C(=O)OC)N=CC3=CC=CC=C3)C(=O)[O-])C
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Product OPENEYE NAME: (7E)-6-(benzylideneamino)-7-(2-methoxy-2-oxo-ethylidene)-3,3-dimethyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
CAS Name: (7E)-7-(2-methoxy-2-oxoethylidene)-3,3-dimethyl-6-[(phenylmethylene)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
IUPAC NAME: (7E)-6-(benzylideneamino)-7-(2-methoxy-2-oxoethylidene)-3,3-dimethyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
SYSTEMATIC NAME: (7E)-7-(2-methoxy-2-oxidanylidene-ethylidene)-3,3-dimethyl-6-[(phenylmethylidene)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
MOLECULAR FORMULA: C18H20N2O4S
MOLECULAR WEIGHT: 360.4274
SMILES: CC1(C(N\2C(S1)C(/C2=C\C(=O)OC)N=CC3=CC=CC=C3)C(=O)O)C
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Product OPENEYE NAME: (3Z,7Z)-2-benzyl-3-[2-(1,3-dioxoisoindolin-2-yl)ethylidene]-7-(2-methoxy-2-oxo-ethylidene)-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylate
CAS Name: (3Z,7Z)-3-[2-(1,3-dioxo-2-isoindolyl)ethylidene]-7-(2-methoxy-2-oxoethylidene)-2-(phenylmethyl)-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylate
IUPAC NAME: (3Z,7Z)-2-benzyl-3-[2-(1,3-dioxoisoindol-2-yl)ethylidene]-7-(2-methoxy-2-oxoethylidene)-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylate
SYSTEMATIC NAME: (3Z,7Z)-3-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethylidene]-7-(2-methoxy-2-oxidanylidene-ethylidene)-2-(phenylmethyl)-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylate
MOLECULAR FORMULA: C26H21N2O7-
MOLECULAR WEIGHT: 473.45414
SMILES: COC(=O)/C=C\1/CC2N1C(/C(=C/CN3C(=O)C4=CC=CC=C4C3=O)/O2)(CC5=CC=CC=C5)C(=O)[O-]
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Product OPENEYE NAME: (3Z,7Z)-2-benzyl-3-[2-(1,3-dioxoisoindolin-2-yl)ethylidene]-7-(2-methoxy-2-oxo-ethylidene)-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
CAS Name: (3Z,7Z)-3-[2-(1,3-dioxo-2-isoindolyl)ethylidene]-7-(2-methoxy-2-oxoethylidene)-2-(phenylmethyl)-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
IUPAC NAME: (3Z,7Z)-2-benzyl-3-[2-(1,3-dioxoisoindol-2-yl)ethylidene]-7-(2-methoxy-2-oxoethylidene)-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
SYSTEMATIC NAME: (3Z,7Z)-3-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethylidene]-7-(2-methoxy-2-oxidanylidene-ethylidene)-2-(phenylmethyl)-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
MOLECULAR FORMULA: C26H22N2O7
MOLECULAR WEIGHT: 474.46208
SMILES: COC(=O)/C=C\1/CC2N1C(/C(=C/CN3C(=O)C4=CC=CC=C4C3=O)/O2)(CC5=CC=CC=C5)C(=O)O
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Product OPENEYE NAME: (3Z,7Z)-3-(2-hydroxyethylidene)-6-(1-hydroxypropyl)-7-(2-methoxy-2-oxo-ethylidene)-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylate
CAS Name: (3Z,7Z)-3-(2-hydroxyethylidene)-6-(1-hydroxypropyl)-7-(2-methoxy-2-oxoethylidene)-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylate
IUPAC NAME: (3Z,7Z)-3-(2-hydroxyethylidene)-6-(1-hydroxypropyl)-7-(2-methoxy-2-oxoethylidene)-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylate
SYSTEMATIC NAME: (3Z,7Z)-7-(2-methoxy-2-oxidanylidene-ethylidene)-3-(2-oxidanylethylidene)-6-(1-oxidanylpropyl)-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylate
MOLECULAR FORMULA: C14H18NO7-
MOLECULAR WEIGHT: 312.29522
SMILES: CCC(C\1C2N(/C1=C\C(=O)OC)C(/C(=C/CO)/O2)C(=O)[O-])O
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Product OPENEYE NAME: (3Z,7Z)-3-(2-hydroxyethylidene)-6-(1-hydroxypropyl)-7-(2-methoxy-2-oxo-ethylidene)-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
CAS Name: (3Z,7Z)-3-(2-hydroxyethylidene)-6-(1-hydroxypropyl)-7-(2-methoxy-2-oxoethylidene)-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
IUPAC NAME: (3Z,7Z)-3-(2-hydroxyethylidene)-6-(1-hydroxypropyl)-7-(2-methoxy-2-oxoethylidene)-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
SYSTEMATIC NAME: (3Z,7Z)-7-(2-methoxy-2-oxidanylidene-ethylidene)-3-(2-oxidanylethylidene)-6-(1-oxidanylpropyl)-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
MOLECULAR FORMULA: C14H19NO7
MOLECULAR WEIGHT: 313.30316
SMILES: CCC(C\1C2N(/C1=C\C(=O)OC)C(/C(=C/CO)/O2)C(=O)O)O
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Product OPENEYE NAME: (3E,7E)-3-[2-(diethylamino)ethylidene]-7-(2-methoxy-2-oxo-ethylidene)-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylate
CAS Name: (3E,7E)-3-[2-(diethylamino)ethylidene]-7-(2-methoxy-2-oxoethylidene)-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylate
IUPAC NAME: (3E,7E)-3-[2-(diethylamino)ethylidene]-7-(2-methoxy-2-oxoethylidene)-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylate
SYSTEMATIC NAME: (3E,7E)-3-[2-(diethylamino)ethylidene]-7-(2-methoxy-2-oxidanylidene-ethylidene)-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylate
MOLECULAR FORMULA: C15H21N2O5-
MOLECULAR WEIGHT: 309.33764
SMILES: CCN(CC)C/C=C/1\C(N\2C(O1)C/C2=C\C(=O)OC)C(=O)[O-]
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Product OPENEYE NAME: (3E,7E)-3-[2-(diethylamino)ethylidene]-7-(2-methoxy-2-oxo-ethylidene)-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
CAS Name: (3E,7E)-3-[2-(diethylamino)ethylidene]-7-(2-methoxy-2-oxoethylidene)-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
IUPAC NAME: (3E,7E)-3-[2-(diethylamino)ethylidene]-7-(2-methoxy-2-oxoethylidene)-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
SYSTEMATIC NAME: (3E,7E)-3-[2-(diethylamino)ethylidene]-7-(2-methoxy-2-oxidanylidene-ethylidene)-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
MOLECULAR FORMULA: C15H22N2O5
MOLECULAR WEIGHT: 310.34558
SMILES: CCN(CC)C/C=C/1\C(N\2C(O1)C/C2=C\C(=O)OC)C(=O)O
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Product OPENEYE NAME: (7Z)-7-(2-methoxy-2-oxo-ethylidene)-3-oxo-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylate
CAS Name: (7Z)-7-(2-methoxy-2-oxoethylidene)-3-oxo-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylate
IUPAC NAME: (7Z)-7-(2-methoxy-2-oxoethylidene)-3-oxo-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylate
SYSTEMATIC NAME: (7Z)-7-(2-methoxy-2-oxidanylidene-ethylidene)-3-oxidanylidene-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylate
MOLECULAR FORMULA: C9H8NO6-
MOLECULAR WEIGHT: 226.16292
SMILES: COC(=O)/C=C\1/CC2N1C(C(=O)O2)C(=O)[O-]
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