Sunday, December 4, 2011

http://ChemLookup.com Compounds




CAS RN: 99108-12-0
CAS Name: 5-(aminomethylidene)-1,3-dibutyl-1,3-diazinane-2,4,6-trione
OPENEYE Name: 5-(aminomethylene)-1,3-dibutyl-hexahydropyrimidine-2,4,6-trione
IUPAC Name: 5-(aminomethylidene)-1,3-dibutyl-1,3-diazinane-2,4,6-trione
SYSTEMATIC NAME: 5-(azanylmethylidene)-1,3-dibutyl-1,3-diazinane-2,4,6-trione
MOLECULAR FORMULA: C13H21N3O3
MOLECULAR WEIGHT: 267.32414
SMILES: CCCCN1C(=O)C(=CN)C(=O)N(C1=O)CCCC
Structure:

CAS RN: 41459-10-3
CAS Name: (5Z)-5-(dimethylaminohydrazinylidene)-2-methyl-4-imidazolecarboxylic acid ethyl ester
OPENEYE Name: ethyl (5Z)-5-(dimethylaminohydrazono)-2-methyl-imidazole-4-carboxylate
IUPAC Name: ethyl (5Z)-5-(dimethylaminohydrazinylidene)-2-methylimidazole-4-carboxylate
SYSTEMATIC NAME: ethyl (5Z)-5-(dimethylaminohydrazinylidene)-2-methyl-imidazole-4-carboxylate
MOLECULAR FORMULA: C9H15N5O2
MOLECULAR WEIGHT: 225.2477
SMILES: CCOC(=O)C\1=NC(=N/C1=N\NN(C)C)C
Structure:

CAS RN: 37126-45-7
CAS Name: (5Z)-5-(dimethylaminohydrazinylidene)-2-phenyl-4-imidazolecarboxylic acid ethyl ester
OPENEYE Name: ethyl (5Z)-5-(dimethylaminohydrazono)-2-phenyl-imidazole-4-carboxylate
IUPAC Name: ethyl (5Z)-5-(dimethylaminohydrazinylidene)-2-phenylimidazole-4-carboxylate
SYSTEMATIC NAME: ethyl (5Z)-5-(dimethylaminohydrazinylidene)-2-phenyl-imidazole-4-carboxylate
MOLECULAR FORMULA: C14H17N5O2
MOLECULAR WEIGHT: 287.31708
SMILES: CCOC(=O)C\1=NC(=N/C1=N\NN(C)C)C2=CC=CC=C2
Structure:

CAS RN: 63657-15-8
CAS Name: 1-[6-[[(1S,3S)-3-acetyl-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-2,4-dihydro-1H-tetracen-1-yl]oxy]-3-hydroxy-2-methyl-4-oxanyl]-3-(4-fluorophenyl)thiourea
OPENEYE Name: 1-[6-[[(1S,3S)-3-acetyl-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-2,4-dihydro-1H-tetracen-1-yl]oxy]-3-hydroxy-2-methyl-tetrahydropyran-4-yl]-3-(4-fluorophenyl)thiourea
IUPAC Name: 1-[6-[[(1S,3S)-3-acetyl-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-2,4-dihydro-1H-tetracen-1-yl]oxy]-3-hydroxy-2-methyloxan-4-yl]-3-(4-fluorophenyl)thiourea
SYSTEMATIC NAME: 1-[6-[[(1S,3S)-3-ethanoyl-10-methoxy-3,5,12-tris(oxidanyl)-6,11-bis(oxidanylidene)-2,4-dihydro-1H-tetracen-1-yl]oxy]-2-methyl-3-oxidanyl-oxan-4-yl]-3-(4-fluorophenyl)thiourea
MOLECULAR FORMULA: C34H33FN2O10S
MOLECULAR WEIGHT: 680.696623
SMILES: CC1C(C(CC(O1)O[C@H]2C[C@@](CC3=C(C4=C(C(=C23)O)C(=O)C5=C(C4=O)C=CC=C5OC)O)(C(=O)C)O)NC(=S)NC6=CC=C(C=C6)F)O
Structure:

CAS RN: 53338-44-6
CAS Name: 5,6-dibromo-2-(trifluoromethyl)-1H-imidazo[4,5-b]pyrazine
OPENEYE Name: 5,6-dibromo-2-(trifluoromethyl)-1H-imidazo[4,5-b]pyrazine
IUPAC Name: 5,6-dibromo-2-(trifluoromethyl)-1H-imidazo[4,5-b]pyrazine
SYSTEMATIC NAME: 5,6-bis(bromanyl)-2-(trifluoromethyl)-1H-imidazo[4,5-b]pyrazine
MOLECULAR FORMULA: C6HBr2F3N4
MOLECULAR WEIGHT: 345.90215
SMILES: C12=C(N=C(C(=N1)Br)Br)N=C(N2)C(F)(F)F
Structure:

CAS RN: 58885-02-2
CAS Name: 5,6-dichloro-2-(chloromethyl)-1H-imidazo[4,5-b]pyrazine
OPENEYE Name: 5,6-dichloro-2-(chloromethyl)-1H-imidazo[4,5-b]pyrazine
IUPAC Name: 5,6-dichloro-2-(chloromethyl)-1H-imidazo[4,5-b]pyrazine
SYSTEMATIC NAME: 5,6-bis(chloranyl)-2-(chloromethyl)-1H-imidazo[4,5-b]pyrazine
MOLECULAR FORMULA: C6H3Cl3N4
MOLECULAR WEIGHT: 237.47382
SMILES: C(C1=NC2=C(N1)N=C(C(=N2)Cl)Cl)Cl
Structure:

CAS RN: 58885-15-7
CAS Name: (5,6-dichloro-1H-imidazo[4,5-b]pyrazin-2-yl)methanol
OPENEYE Name: (5,6-dichloro-1H-imidazo[4,5-b]pyrazin-2-yl)methanol
IUPAC Name: (5,6-dichloro-1H-imidazo[4,5-b]pyrazin-2-yl)methanol
SYSTEMATIC NAME: [5,6-bis(chloranyl)-1H-imidazo[4,5-b]pyrazin-2-yl]methanol
MOLECULAR FORMULA: C6H4Cl2N4O
MOLECULAR WEIGHT: 219.02816
SMILES: C(C1=NC2=C(N1)N=C(C(=N2)Cl)Cl)O
Structure:

CAS RN: 70740-17-9
CAS Name: 6-[(3-chloro-2-methylanilino)methylidene]-1-cyclohexa-2,4-dienone
OPENEYE Name: 6-[(3-chloro-2-methyl-anilino)methylene]cyclohexa-2,4-dien-1-one
IUPAC Name: 6-[(3-chloro-2-methylanilino)methylidene]cyclohexa-2,4-dien-1-one
SYSTEMATIC NAME: 6-[[(3-chloranyl-2-methyl-phenyl)amino]methylidene]cyclohexa-2,4-dien-1-one
MOLECULAR FORMULA: C14H12ClNO
MOLECULAR WEIGHT: 245.70418
SMILES: CC1=C(C=CC=C1Cl)NC=C2C=CC=CC2=O
Structure:

CAS RN: 58285-74-8
CAS Name: 4-[(4-chloroanilino)methylidene]-2-methoxy-1-cyclohexa-2,5-dienone
OPENEYE Name: 4-[(4-chloroanilino)methylene]-2-methoxy-cyclohexa-2,5-dien-1-one
IUPAC Name: 4-[(4-chloroanilino)methylidene]-2-methoxycyclohexa-2,5-dien-1-one
SYSTEMATIC NAME: 4-[[(4-chlorophenyl)amino]methylidene]-2-methoxy-cyclohexa-2,5-dien-1-one
MOLECULAR FORMULA: C14H12ClNO2
MOLECULAR WEIGHT: 261.70358
SMILES: COC1=CC(=CNC2=CC=C(C=C2)Cl)C=CC1=O
Structure:

CAS RN: 120-70-7
CAS Name: (6E)-6-[[3-[[(E)-(6-oxo-1-cyclohexa-2,4-dienylidene)methyl]amino]propylamino]methylidene]-1-cyclohexa-2,4-dienone
OPENEYE Name: (6E)-6-[[3-[[(E)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]propylamino]methylene]cyclohexa-2,4-dien-1-one
IUPAC Name: (6E)-6-[[3-[[(E)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]propylamino]methylidene]cyclohexa-2,4-dien-1-one
SYSTEMATIC NAME: (6E)-6-[[3-[[(E)-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)methyl]amino]propylamino]methylidene]cyclohexa-2,4-dien-1-one
MOLECULAR FORMULA: C17H18N2O2
MOLECULAR WEIGHT: 282.33702
SMILES: C1=C/C(=C\NCCCN/C=C\2/C(=O)C=CC=C2)/C(=O)C=C1
Structure:

CAS RN: 92231-41-9
CAS Name: 6-[(5-chloro-2-methylanilino)methylidene]-1-cyclohexa-2,4-dienone
OPENEYE Name: 6-[(5-chloro-2-methyl-anilino)methylene]cyclohexa-2,4-dien-1-one
IUPAC Name: 6-[(5-chloro-2-methylanilino)methylidene]cyclohexa-2,4-dien-1-one
SYSTEMATIC NAME: 6-[[(5-chloranyl-2-methyl-phenyl)amino]methylidene]cyclohexa-2,4-dien-1-one
MOLECULAR FORMULA: C14H12ClNO
MOLECULAR WEIGHT: 245.70418
SMILES: CC1=C(C=C(C=C1)Cl)NC=C2C=CC=CC2=O
Structure:

CAS RN: 51043-68-6
CAS Name: 2-[[[4-[(7-amino-5-oxo-8H-pyrimido[5,4-e][1,2,4]triazin-3-yl)methylamino]phenyl]-oxomethyl]amino]pentanedioic acid
OPENEYE Name: 2-[[4-[(7-amino-5-oxo-8H-pyrimido[5,4-e][1,2,4]triazin-3-yl)methylamino]benzoyl]amino]pentanedioic acid
IUPAC Name: 2-[[4-[(7-amino-5-oxo-8H-pyrimido[5,4-e][1,2,4]triazin-3-yl)methylamino]benzoyl]amino]pentanedioic acid
SYSTEMATIC NAME: 2-[[4-[(7-azanyl-5-oxidanylidene-8H-pyrimido[5,4-e][1,2,4]triazin-3-yl)methylamino]phenyl]carbonylamino]pentanedioic acid
MOLECULAR FORMULA: C18H18N8O6
MOLECULAR WEIGHT: 442.38552
SMILES: C1=CC(=CC=C1C(=O)NC(CCC(=O)O)C(=O)O)NCC2=NC3=C(NC(=NC3=O)N)N=N2
Structure:

CAS RN: 57464-42-3
CAS Name: 6-(methylthio)-N-(2-pyrrolylidenemethyl)-9-purinamine
OPENEYE Name: 6-methylsulfanyl-N-(pyrrol-2-ylidenemethyl)purin-9-amine
IUPAC Name: 6-methylsulfanyl-N-(pyrrol-2-ylidenemethyl)purin-9-amine
SYSTEMATIC NAME: 6-methylsulfanyl-N-(pyrrol-2-ylidenemethyl)purin-9-amine
MOLECULAR FORMULA: C11H10N6S
MOLECULAR WEIGHT: 258.3023
SMILES: CSC1=NC=NC2=C1N=CN2NC=C3C=CC=N3
Structure:

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