Saturday, December 3, 2011

http://ChemLookup.com Compounds




CAS RN: 6833-64-3
CAS Name: 4-(phenylhydrazo)cyclohexa-3,5-diene-1,2-dione
OPENEYE Name: 4-(2-phenylhydrazino)-1,2-benzoquinone
IUPAC Name: 4-(2-phenylhydrazinyl)cyclohexa-3,5-diene-1,2-dione
SYSTEMATIC NAME: 4-(2-phenylhydrazinyl)cyclohexa-3,5-diene-1,2-dione
MOLECULAR FORMULA: C12H10N2O2
MOLECULAR WEIGHT: 214.22
SMILES: C1=CC=C(C=C1)NNC2=CC(=O)C(=O)C=C2
Structure:

CAS RN: 29096-99-9
CAS Name: (Z)-2-cyano-3-ethoxy-2-propenoic acid methyl ester
OPENEYE Name: methyl (Z)-2-cyano-3-ethoxy-prop-2-enoate
IUPAC Name: methyl (Z)-2-cyano-3-ethoxyprop-2-enoate
SYSTEMATIC NAME: methyl (Z)-2-cyano-3-ethoxy-prop-2-enoate
MOLECULAR FORMULA: C7H9NO3
MOLECULAR WEIGHT: 155.15126
SMILES: CCO/C=C(/C#N)\C(=O)OC
Structure:

CAS RN: 15871-95-1
CAS Name: 5-(hydroxymethyl)-4-[[[(Z)-[5-(hydroxymethyl)-2-methyl-3-oxo-4-pyridinylidene]methyl]hydrazo]methylidene]-2-methyl-3-pyridinone
OPENEYE Name: 5-(hydroxymethyl)-4-[[2-[(Z)-[5-(hydroxymethyl)-2-methyl-3-oxo-4-pyridylidene]methyl]hydrazino]methylene]-2-methyl-pyridin-3-one
IUPAC Name: 5-(hydroxymethyl)-4-[[2-[(Z)-[5-(hydroxymethyl)-2-methyl-3-oxopyridin-4-ylidene]methyl]hydrazinyl]methylidene]-2-methylpyridin-3-one
SYSTEMATIC NAME: 5-(hydroxymethyl)-4-[[2-[(Z)-[5-(hydroxymethyl)-2-methyl-3-oxidanylidene-pyridin-4-ylidene]methyl]hydrazinyl]methylidene]-2-methyl-pyridin-3-one
MOLECULAR FORMULA: C16H18N4O4
MOLECULAR WEIGHT: 330.33852
SMILES: CC1=NC=C(C(=CNN/C=C\2/C(=CN=C(C2=O)C)CO)C1=O)CO
Structure:

CAS RN: 49600-56-8
CAS Name: 5,7-dimethyl-2-sulfanylidene-1H-pyrido[2,3-d]pyrimidin-4-one
OPENEYE Name: 5,7-dimethyl-2-thioxo-1H-pyrido[2,3-d]pyrimidin-4-one
IUPAC Name: 5,7-dimethyl-2-sulfanylidene-1H-pyrido[2,3-d]pyrimidin-4-one
SYSTEMATIC NAME: 5,7-dimethyl-2-sulfanylidene-1H-pyrido[2,3-d]pyrimidin-4-one
MOLECULAR FORMULA: C9H9N3OS
MOLECULAR WEIGHT: 207.25226
SMILES: CC1=CC(=NC2=C1C(=O)NC(=S)N2)C
Structure:

CAS RN: 16968-07-3
CAS Name: (5-amino-4-triazolylidene)methanediamine
OPENEYE Name: (5-aminotriazol-4-ylidene)methanediamine
IUPAC Name: (5-aminotriazol-4-ylidene)methanediamine
SYSTEMATIC NAME: (5-azanyl-1,2,3-triazol-4-ylidene)methanediamine
MOLECULAR FORMULA: C3H6N6
MOLECULAR WEIGHT: 126.11994
SMILES: C1(=C(N)N)C(=NN=N1)N
Structure:

CAS RN: 90000-82-1
CAS Name: 5-(aminomethylidene)-1,3-dimethyl-1,3-diazinane-2,4,6-trione
OPENEYE Name: 5-(aminomethylene)-1,3-dimethyl-hexahydropyrimidine-2,4,6-trione
IUPAC Name: 5-(aminomethylidene)-1,3-dimethyl-1,3-diazinane-2,4,6-trione
SYSTEMATIC NAME: 5-(azanylmethylidene)-1,3-dimethyl-1,3-diazinane-2,4,6-trione
MOLECULAR FORMULA: C7H9N3O3
MOLECULAR WEIGHT: 183.16466
SMILES: CN1C(=O)C(=CN)C(=O)N(C1=O)C
Structure:

CAS RN: 10344-21-5
CAS Name: N'-[(E)-2-pyrrolylidenemethyl]-4-pyridinecarbohydrazide
OPENEYE Name: N'-[(E)-pyrrol-2-ylidenemethyl]pyridine-4-carbohydrazide
IUPAC Name: N'-[(E)-pyrrol-2-ylidenemethyl]pyridine-4-carbohydrazide
SYSTEMATIC NAME: N'-[(E)-pyrrol-2-ylidenemethyl]pyridine-4-carbohydrazide
MOLECULAR FORMULA: C11H10N4O
MOLECULAR WEIGHT: 214.2233
SMILES: C1=C/C(=C\NNC(=O)C2=CC=NC=C2)/N=C1
Structure:

CAS RN: 14160-86-2
CAS Name: 2-methyl-5-[(phenylhydrazo)methylidene]-1H-pyrimidine-4,6-dione
OPENEYE Name: 2-methyl-5-[(2-phenylhydrazino)methylene]-1H-pyrimidine-4,6-dione
IUPAC Name: 2-methyl-5-[(2-phenylhydrazinyl)methylidene]-1H-pyrimidine-4,6-dione
SYSTEMATIC NAME: 2-methyl-5-[(2-phenylhydrazinyl)methylidene]-1H-pyrimidine-4,6-dione
MOLECULAR FORMULA: C12H12N4O2
MOLECULAR WEIGHT: 244.24928
SMILES: CC1=NC(=O)C(=CNNC2=CC=CC=C2)C(=O)N1
Structure:

CAS RN: 17360-67-7
CAS Name: (5E)-5-[[(2,4-dinitrophenyl)hydrazo]methylidene]pyrimidine-2,4-dione
OPENEYE Name: (5E)-5-[[2-(2,4-dinitrophenyl)hydrazino]methylene]pyrimidine-2,4-dione
IUPAC Name: (5E)-5-[[2-(2,4-dinitrophenyl)hydrazinyl]methylidene]pyrimidine-2,4-dione
SYSTEMATIC NAME: (5E)-5-[[2-(2,4-dinitrophenyl)hydrazinyl]methylidene]pyrimidine-2,4-dione
MOLECULAR FORMULA: C11H8N6O6
MOLECULAR WEIGHT: 320.21782
SMILES: C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])NN/C=C/2\C=NC(=O)NC2=O
Structure:

CAS RN: 14859-92-8
CAS Name: 5-[(phenylhydrazo)methylidene]pyrimidine-2,4-dione
OPENEYE Name: 5-[(2-phenylhydrazino)methylene]pyrimidine-2,4-dione
IUPAC Name: 5-[(2-phenylhydrazinyl)methylidene]pyrimidine-2,4-dione
SYSTEMATIC NAME: 5-[(2-phenylhydrazinyl)methylidene]pyrimidine-2,4-dione
MOLECULAR FORMULA: C11H10N4O2
MOLECULAR WEIGHT: 230.2227
SMILES: C1=CC=C(C=C1)NNC=C2C=NC(=O)NC2=O
Structure:

CAS RN: 7410-57-3
CAS Name: [[(2-hydroxy-4-oxo-1-cyclohexa-2,5-dienylidene)-phenylmethyl]amino]thiourea
OPENEYE Name: [[(2-hydroxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)-phenyl-methyl]amino]thiourea
IUPAC Name: [[(2-hydroxy-4-oxocyclohexa-2,5-dien-1-ylidene)-phenylmethyl]amino]thiourea
SYSTEMATIC NAME: 1-[[(2-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-phenyl-methyl]amino]thiourea
MOLECULAR FORMULA: C14H13N3O2S
MOLECULAR WEIGHT: 287.33692
SMILES: C1=CC=C(C=C1)C(=C2C=CC(=O)C=C2O)NNC(=S)N
Structure:

CAS RN: 89322-70-3
CAS Name: (2Z)-2-[amino(mercapto)methylidene]-3-oxobutanenitrile
OPENEYE Name: (2Z)-2-[amino(sulfanyl)methylene]-3-oxo-butanenitrile
IUPAC Name: (2Z)-2-[amino(sulfanyl)methylidene]-3-oxobutanenitrile
SYSTEMATIC NAME: (2Z)-2-[azanyl(sulfanyl)methylidene]-3-oxidanylidene-butanenitrile
MOLECULAR FORMULA: C5H6N2OS
MOLECULAR WEIGHT: 142.17894
SMILES: CC(=O)/C(=C(/N)\S)/C#N
Structure:

CAS RN: 29955-36-0
CAS Name: (5E)-5-[(hydroxyamino)methylidene]-6-methylpyrimidine-2,4-dione
OPENEYE Name: (5E)-5-[(hydroxyamino)methylene]-6-methyl-pyrimidine-2,4-dione
IUPAC Name: (5E)-5-[(hydroxyamino)methylidene]-6-methylpyrimidine-2,4-dione
SYSTEMATIC NAME: (5E)-6-methyl-5-[(oxidanylamino)methylidene]pyrimidine-2,4-dione
MOLECULAR FORMULA: C6H7N3O3
MOLECULAR WEIGHT: 169.13808
SMILES: CC\1=NC(=O)NC(=O)/C1=C/NO
Structure:

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