Saturday, June 29, 2013

All Chemical Compounds Information




Product OPENEYE NAME: sodium N-[methoxy(sulfido)phosphoryl]methanamine
CAS Name: sodium N-[methoxy(sulfido)phosphoryl]methanamine
IUPAC NAME: sodium N-[methoxy(sulfido)phosphoryl]methanamine
SYSTEMATIC NAME: sodium N-[methoxy(sulfanidyl)phosphoryl]methanamine
MOLECULAR FORMULA: C2H7NNaO2PS
MOLECULAR WEIGHT: 163.111011
SMILES: CNP(=O)(OC)[S-].[Na+]
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Product OPENEYE NAME: [3-[formyl(2-pyridyl)amino]-2-methyl-1,1-dioxo-1$l^{6},2-benzothiazin-4-yl] (E)-3-phenylprop-2-enoate
CAS Name: (E)-3-phenyl-2-propenoic acid [3-[formyl(2-pyridinyl)amino]-2-methyl-1,1-dioxo-1$l^{6},2-benzothiazin-4-yl] ester
IUPAC NAME: [3-[formyl(pyridin-2-yl)amino]-2-methyl-1,1-dioxo-1$l^{6},2-benzothiazin-4-yl] (E)-3-phenylprop-2-enoate
SYSTEMATIC NAME: [3-[methanoyl(pyridin-2-yl)amino]-2-methyl-1,1-bis(oxidanylidene)-1$l^{6},2-benzothiazin-4-yl] (E)-3-phenylprop-2-enoate
MOLECULAR FORMULA: C24H19N3O5S
MOLECULAR WEIGHT: 461.48976
SMILES: CN1C(=C(C2=CC=CC=C2S1(=O)=O)OC(=O)/C=C/C3=CC=CC=C3)N(C=O)C4=CC=CC=N4
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Product OPENEYE NAME: N-(1,1,4-trioxo-2,3-dihydro-1$l^{6},2-benzothiazin-3-yl)formamide
CAS Name: N-(1,1,4-trioxo-2,3-dihydro-1$l^{6},2-benzothiazin-3-yl)formamide
IUPAC NAME: N-(1,1,4-trioxo-2,3-dihydro-1$l^{6},2-benzothiazin-3-yl)formamide
SYSTEMATIC NAME: N-[1,1,4-tris(oxidanylidene)-2,3-dihydro-1$l^{6},2-benzothiazin-3-yl]methanamide
MOLECULAR FORMULA: C9H8N2O4S
MOLECULAR WEIGHT: 240.23582
SMILES: C1=CC=C2C(=C1)C(=O)C(NS2(=O)=O)NC=O
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Product OPENEYE NAME: (9Z)-9-[(2,4-dinitrophenyl)hydrazono]-6-methyl-4-oxo-7,8-dihydro-6H-pyrido[1,2-a]pyrimidine-3-carboxylic acid
CAS Name: (9Z)-9-[(2,4-dinitrophenyl)hydrazinylidene]-6-methyl-4-oxo-7,8-dihydro-6H-pyrido[1,2-a]pyrimidine-3-carboxylic acid
IUPAC NAME: (9Z)-9-[(2,4-dinitrophenyl)hydrazinylidene]-6-methyl-4-oxo-7,8-dihydro-6H-pyrido[1,2-a]pyrimidine-3-carboxylic acid
SYSTEMATIC NAME: (9Z)-9-[(2,4-dinitrophenyl)hydrazinylidene]-6-methyl-4-oxidanylidene-7,8-dihydro-6H-pyrido[1,2-a]pyrimidine-3-carboxylic acid
MOLECULAR FORMULA: C16H14N6O7
MOLECULAR WEIGHT: 402.31836
SMILES: CC1CC/C(=N/NC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])/C3=NC=C(C(=O)N13)C(=O)O
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Product OPENEYE NAME: ethyl (9E)-6-methyl-4-oxo-9-[(4-sulfamoylphenyl)hydrazono]-7,8-dihydro-6H-pyrido[1,2-a]pyrimidine-3-carboxylate hydrate
CAS Name: (9E)-6-methyl-4-oxo-9-[(4-sulfamoylphenyl)hydrazinylidene]-7,8-dihydro-6H-pyrido[1,2-a]pyrimidine-3-carboxylic acid ethyl ester hydrate
IUPAC NAME: ethyl (9E)-6-methyl-4-oxo-9-[(4-sulfamoylphenyl)hydrazinylidene]-7,8-dihydro-6H-pyrido[1,2-a]pyrimidine-3-carboxylate hydrate
SYSTEMATIC NAME: ethyl (9E)-6-methyl-4-oxidanylidene-9-[(4-sulfamoylphenyl)hydrazinylidene]-7,8-dihydro-6H-pyrido[1,2-a]pyrimidine-3-carboxylate hydrate
MOLECULAR FORMULA: C18H23N5O6S
MOLECULAR WEIGHT: 437.47012
SMILES: CCOC(=O)C1=CN=C2/C(=N/NC3=CC=C(C=C3)S(=O)(=O)N)/CCC(N2C1=O)C.O
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Product OPENEYE NAME: (9Z)-9-[(3-iodophenyl)hydrazono]-6-methyl-4-oxo-7,8-dihydro-6H-pyrido[1,2-a]pyrimidine-3-carboxylic acid
CAS Name: (9Z)-9-[(3-iodophenyl)hydrazinylidene]-6-methyl-4-oxo-7,8-dihydro-6H-pyrido[1,2-a]pyrimidine-3-carboxylic acid
IUPAC NAME: (9Z)-9-[(3-iodophenyl)hydrazinylidene]-6-methyl-4-oxo-7,8-dihydro-6H-pyrido[1,2-a]pyrimidine-3-carboxylic acid
SYSTEMATIC NAME: (9Z)-9-[(3-iodanylphenyl)hydrazinylidene]-6-methyl-4-oxidanylidene-7,8-dihydro-6H-pyrido[1,2-a]pyrimidine-3-carboxylic acid
MOLECULAR FORMULA: C16H15IN4O3
MOLECULAR WEIGHT: 438.21977
SMILES: CC1CC/C(=N/NC2=CC(=CC=C2)I)/C3=NC=C(C(=O)N13)C(=O)O
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Product OPENEYE NAME: (9Z)-6-methyl-9-(2-naphthylhydrazono)-4-oxo-7,8-dihydro-6H-pyrido[1,2-a]pyrimidine-3-carboxylic acid
CAS Name: (9Z)-6-methyl-9-(2-naphthalenylhydrazinylidene)-4-oxo-7,8-dihydro-6H-pyrido[1,2-a]pyrimidine-3-carboxylic acid
IUPAC NAME: (9Z)-6-methyl-9-(naphthalen-2-ylhydrazinylidene)-4-oxo-7,8-dihydro-6H-pyrido[1,2-a]pyrimidine-3-carboxylic acid
SYSTEMATIC NAME: (9Z)-6-methyl-9-(naphthalen-2-ylhydrazinylidene)-4-oxidanylidene-7,8-dihydro-6H-pyrido[1,2-a]pyrimidine-3-carboxylic acid
MOLECULAR FORMULA: C20H18N4O3
MOLECULAR WEIGHT: 362.38192
SMILES: CC1CC/C(=N/NC2=CC3=CC=CC=C3C=C2)/C4=NC=C(C(=O)N14)C(=O)O
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Product OPENEYE NAME: (9Z)-6-methyl-4-oxo-9-[(4-phenylphenyl)hydrazono]-7,8-dihydro-6H-pyrido[1,2-a]pyrimidine-3-carboxylic acid
CAS Name: (9Z)-6-methyl-4-oxo-9-[(4-phenylphenyl)hydrazinylidene]-7,8-dihydro-6H-pyrido[1,2-a]pyrimidine-3-carboxylic acid
IUPAC NAME: (9Z)-6-methyl-4-oxo-9-[(4-phenylphenyl)hydrazinylidene]-7,8-dihydro-6H-pyrido[1,2-a]pyrimidine-3-carboxylic acid
SYSTEMATIC NAME: (9Z)-6-methyl-4-oxidanylidene-9-[(4-phenylphenyl)hydrazinylidene]-7,8-dihydro-6H-pyrido[1,2-a]pyrimidine-3-carboxylic acid
MOLECULAR FORMULA: C22H20N4O3
MOLECULAR WEIGHT: 388.4192
SMILES: CC1CC/C(=N/NC2=CC=C(C=C2)C3=CC=CC=C3)/C4=NC=C(C(=O)N14)C(=O)O
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Product OPENEYE NAME: (9Z)-9-hydrazinylidene-6-methyl-4-oxo-7,8-dihydro-6H-pyrido[1,2-a]pyrimidine-3-carbohydrazide
CAS Name: (9Z)-9-hydrazinylidene-6-methyl-4-oxo-7,8-dihydro-6H-pyrido[1,2-a]pyrimidine-3-carbohydrazide
IUPAC NAME: (9Z)-9-hydrazinylidene-6-methyl-4-oxo-7,8-dihydro-6H-pyrido[1,2-a]pyrimidine-3-carbohydrazide
SYSTEMATIC NAME: (9Z)-9-diazanylidene-6-methyl-4-oxidanylidene-7,8-dihydro-6H-pyrido[1,2-a]pyrimidine-3-carbohydrazide
MOLECULAR FORMULA: C10H14N6O2
MOLECULAR WEIGHT: 250.25716
SMILES: CC1CC/C(=N/N)/C2=NC=C(C(=O)N12)C(=O)NN
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Product OPENEYE NAME: 2-[(9E)-6-methyl-4-oxo-9-(phenylhydrazono)-7,8-dihydro-6H-pyrido[1,2-a]pyrimidin-3-yl]butanoic acid
CAS Name: 2-[(9E)-6-methyl-4-oxo-9-(phenylhydrazinylidene)-7,8-dihydro-6H-pyrido[1,2-a]pyrimidin-3-yl]butanoic acid
IUPAC NAME: 2-[(9E)-6-methyl-4-oxo-9-(phenylhydrazinylidene)-7,8-dihydro-6H-pyrido[1,2-a]pyrimidin-3-yl]butanoic acid
SYSTEMATIC NAME: 2-[(9E)-6-methyl-4-oxidanylidene-9-(phenylhydrazinylidene)-7,8-dihydro-6H-pyrido[1,2-a]pyrimidin-3-yl]butanoic acid
MOLECULAR FORMULA: C19H22N4O3
MOLECULAR WEIGHT: 354.40298
SMILES: CCC(C1=CN=C2/C(=N/NC3=CC=CC=C3)/CCC(N2C1=O)C)C(=O)O
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