Saturday, July 28, 2012

All Chemical Compounds Information




Product OPENEYE NAME: 4-amino-5-oxo-3-phenyl-1-(2-sulfosulfanylethyl)-1,2,4-triazole
CAS Name: 4-amino-5-oxo-3-phenyl-1-[2-(sulfothio)ethyl]-1,2,4-triazole
IUPAC NAME: 4-amino-5-oxo-3-phenyl-1-(2-sulfosulfanylethyl)-1,2,4-triazole
SYSTEMATIC NAME: 4-azanyl-5-oxidanylidene-3-phenyl-1-(2-sulfosulfanylethyl)-1,2,4-triazole
MOLECULAR FORMULA: C10H12N4O4S2
MOLECULAR WEIGHT: 316.35668
SMILES: C1=CC=C(C=C1)C2=NN(C(=O)N2N)CCSS(=O)(=O)O
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Product OPENEYE NAME: 4-amino-3-(4-methoxyphenyl)-5-oxo-1-(2-sulfonatosulfanylethyl)-1,2,4-triazole
CAS Name: 4-amino-3-(4-methoxyphenyl)-5-oxo-1-[2-(sulfonatothio)ethyl]-1,2,4-triazole
IUPAC NAME: 4-amino-3-(4-methoxyphenyl)-5-oxo-1-(2-sulfonatosulfanylethyl)-1,2,4-triazole
SYSTEMATIC NAME: 4-azanyl-3-(4-methoxyphenyl)-5-oxidanylidene-1-(2-sulfonatosulfanylethyl)-1,2,4-triazole
MOLECULAR FORMULA: C11H13N4O5S2-
MOLECULAR WEIGHT: 345.37472
SMILES: COC1=CC=C(C=C1)C2=NN(C(=O)N2N)CCSS(=O)(=O)[O-]
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Product OPENEYE NAME: 4-amino-3-(4-methoxyphenyl)-5-oxo-1-(2-sulfosulfanylethyl)-1,2,4-triazole
CAS Name: 4-amino-3-(4-methoxyphenyl)-5-oxo-1-[2-(sulfothio)ethyl]-1,2,4-triazole
IUPAC NAME: 4-amino-3-(4-methoxyphenyl)-5-oxo-1-(2-sulfosulfanylethyl)-1,2,4-triazole
SYSTEMATIC NAME: 4-azanyl-3-(4-methoxyphenyl)-5-oxidanylidene-1-(2-sulfosulfanylethyl)-1,2,4-triazole
MOLECULAR FORMULA: C11H14N4O5S2
MOLECULAR WEIGHT: 346.38266
SMILES: COC1=CC=C(C=C1)C2=NN(C(=O)N2N)CCSS(=O)(=O)O
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Product OPENEYE NAME: 4-amino-3-(4-chlorophenyl)-5-oxo-1-(2-sulfonatosulfanylethyl)-1,2,4-triazole
CAS Name: 4-amino-3-(4-chlorophenyl)-5-oxo-1-[2-(sulfonatothio)ethyl]-1,2,4-triazole
IUPAC NAME: 4-amino-3-(4-chlorophenyl)-5-oxo-1-(2-sulfonatosulfanylethyl)-1,2,4-triazole
SYSTEMATIC NAME: 4-azanyl-3-(4-chlorophenyl)-5-oxidanylidene-1-(2-sulfonatosulfanylethyl)-1,2,4-triazole
MOLECULAR FORMULA: C10H10ClN4O4S2-
MOLECULAR WEIGHT: 349.7938
SMILES: C1=CC(=CC=C1C2=NN(C(=O)N2N)CCSS(=O)(=O)[O-])Cl
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Product OPENEYE NAME: 4-amino-3-(4-chlorophenyl)-5-oxo-1-(2-sulfosulfanylethyl)-1,2,4-triazole
CAS Name: 4-amino-3-(4-chlorophenyl)-5-oxo-1-[2-(sulfothio)ethyl]-1,2,4-triazole
IUPAC NAME: 4-amino-3-(4-chlorophenyl)-5-oxo-1-(2-sulfosulfanylethyl)-1,2,4-triazole
SYSTEMATIC NAME: 4-azanyl-3-(4-chlorophenyl)-5-oxidanylidene-1-(2-sulfosulfanylethyl)-1,2,4-triazole
MOLECULAR FORMULA: C10H11ClN4O4S2
MOLECULAR WEIGHT: 350.80174
SMILES: C1=CC(=CC=C1C2=NN(C(=O)N2N)CCSS(=O)(=O)O)Cl
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Product OPENEYE NAME: 2-[(Z)-2-(2-phenanthryl)prop-1-enyl]thiophene
CAS Name: 2-[(Z)-2-(2-phenanthrenyl)prop-1-enyl]thiophene
IUPAC NAME: 2-[(Z)-2-phenanthren-2-ylprop-1-enyl]thiophene
SYSTEMATIC NAME: 2-[(Z)-2-phenanthren-2-ylprop-1-enyl]thiophene
MOLECULAR FORMULA: C21H16S
MOLECULAR WEIGHT: 300.41674
SMILES: C/C(=C/C1=CC=CS1)/C2=CC3=C(C=C2)C4=CC=CC=C4C=C3
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Product OPENEYE NAME: 1,3-dioxol-1-ium
CAS Name: 1,3-dioxol-1-ium
IUPAC NAME: 1,3-dioxol-1-ium
SYSTEMATIC NAME: 1,3-dioxol-1-ium
MOLECULAR FORMULA: C3H3O2+
MOLECULAR WEIGHT: 71.05472
SMILES: C1=C[O+]=CO1
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Product OPENEYE NAME: 1,3-oxathiol-1-ium
CAS Name: 1,3-oxathiol-1-ium
IUPAC NAME: 1,3-oxathiol-1-ium
SYSTEMATIC NAME: 1,3-oxathiol-1-ium
MOLECULAR FORMULA: C3H3OS+
MOLECULAR WEIGHT: 87.12032
SMILES: C1=CSC=[O+]1
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Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C20H28O10
MOLECULAR WEIGHT: 428.43032
SMILES: C1CC[C@H]2[C@H](C1)OC(=O)COCC(=O)O[C@H]3CCCC[C@@H]3OC(=O)COCC(=O)O2
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Product OPENEYE NAME: 2-amino-N-[(Z)-1-(dimethylamino)ethylideneamino]benzamide
CAS Name: 2-amino-N-[(Z)-1-(dimethylamino)ethylideneamino]benzamide
IUPAC NAME: 2-amino-N-[(Z)-1-(dimethylamino)ethylideneamino]benzamide
SYSTEMATIC NAME: 2-azanyl-N-[(Z)-1-(dimethylamino)ethylideneamino]benzamide
MOLECULAR FORMULA: C11H16N4O
MOLECULAR WEIGHT: 220.27094
SMILES: C/C(=N/NC(=O)C1=CC=CC=C1N)/N(C)C
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Product OPENEYE NAME: methyl (E)-N-(5-amino-1-benzyl-triazole-4-carbonyl)benzenecarbohydrazonate
CAS Name: (E)-N-[[5-amino-1-(phenylmethyl)-4-triazolyl]-oxomethyl]benzenecarbohydrazonic acid methyl ester
IUPAC NAME: methyl (E)-N-(5-amino-1-benzyltriazole-4-carbonyl)benzenecarbohydrazonate
SYSTEMATIC NAME: methyl (E)-N-[[5-azanyl-1-(phenylmethyl)-1,2,3-triazol-4-yl]carbonyl]benzenecarbohydrazonate
MOLECULAR FORMULA: C18H18N6O2
MOLECULAR WEIGHT: 350.37452
SMILES: CO/C(=N/NC(=O)C1=C(N(N=N1)CC2=CC=CC=C2)N)/C3=CC=CC=C3
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Product OPENEYE NAME: ethyl (1Z)-N-(5-amino-1-benzyl-triazole-4-carbonyl)ethanehydrazonate
CAS Name: (1Z)-N-[[5-amino-1-(phenylmethyl)-4-triazolyl]-oxomethyl]ethanehydrazonic acid ethyl ester
IUPAC NAME: ethyl (1Z)-N-(5-amino-1-benzyltriazole-4-carbonyl)ethanehydrazonate
SYSTEMATIC NAME: ethyl (1Z)-N-[[5-azanyl-1-(phenylmethyl)-1,2,3-triazol-4-yl]carbonyl]ethanehydrazonate
MOLECULAR FORMULA: C14H18N6O2
MOLECULAR WEIGHT: 302.33172
SMILES: CCO/C(=N\NC(=O)C1=C(N(N=N1)CC2=CC=CC=C2)N)/C
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Product OPENEYE NAME: methyl (1E)-N-(2-butyl-6-chloro-4-oxo-quinazolin-3-yl)pentanimidate
CAS Name: (1E)-N-(2-butyl-6-chloro-4-oxo-3-quinazolinyl)pentanimidic acid methyl ester
IUPAC NAME: methyl (1E)-N-(2-butyl-6-chloro-4-oxoquinazolin-3-yl)pentanimidate
SYSTEMATIC NAME: methyl (1E)-N-(2-butyl-6-chloranyl-4-oxidanylidene-quinazolin-3-yl)pentanimidate
MOLECULAR FORMULA: C18H24ClN3O2
MOLECULAR WEIGHT: 349.85506
SMILES: CCCCC1=NC2=C(C=C(C=C2)Cl)C(=O)N1/N=C(\CCCC)/OC
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Product OPENEYE NAME: methyl (1E)-N-(6-bromo-2-butyl-4-oxo-quinazolin-3-yl)pentanimidate
CAS Name: (1E)-N-(6-bromo-2-butyl-4-oxo-3-quinazolinyl)pentanimidic acid methyl ester
IUPAC NAME: methyl (1E)-N-(6-bromo-2-butyl-4-oxoquinazolin-3-yl)pentanimidate
SYSTEMATIC NAME: methyl (1E)-N-(6-bromanyl-2-butyl-4-oxidanylidene-quinazolin-3-yl)pentanimidate
MOLECULAR FORMULA: C18H24BrN3O2
MOLECULAR WEIGHT: 394.30606
SMILES: CCCCC1=NC2=C(C=C(C=C2)Br)C(=O)N1/N=C(\CCCC)/OC
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