Friday, June 29, 2012

http://ChemLookup.com Compounds




CAS RN: 71552-24-4
CAS Name: N4-(3-bromophenyl)pyrimidine-2,4,6-triamine
OPENEYE Name: N4-(3-bromophenyl)pyrimidine-2,4,6-triamine
IUPAC Name: 4-N-(3-bromophenyl)pyrimidine-2,4,6-triamine
SYSTEMATIC NAME: N4-(3-bromophenyl)pyrimidine-2,4,6-triamine
MOLECULAR FORMULA: C10H10BrN5
MOLECULAR WEIGHT: 280.1239
SMILES: C1=CC(=CC(=C1)Br)NC2=NC(=NC(=C2)N)N
Structure:

CAS RN: 54798-21-9
CAS Name: 3-amino-6-[[(4-chlorophenyl)thio]methyl]-2-pyrazinecarbonitrile
OPENEYE Name: 3-amino-6-[(4-chlorophenyl)sulfanylmethyl]pyrazine-2-carbonitrile
IUPAC Name: 3-amino-6-[(4-chlorophenyl)sulfanylmethyl]pyrazine-2-carbonitrile
SYSTEMATIC NAME: 3-azanyl-6-[(4-chlorophenyl)sulfanylmethyl]pyrazine-2-carbonitrile
MOLECULAR FORMULA: C12H9ClN4S
MOLECULAR WEIGHT: 276.74466
SMILES: C1=CC(=CC=C1SCC2=CN=C(C(=N2)C#N)N)Cl
Structure:

CAS RN: 64882-36-6
CAS Name: 3-amino-6-methyl-2-pyrazinecarboxylic acid ethyl ester
OPENEYE Name: ethyl 3-amino-6-methyl-pyrazine-2-carboxylate
IUPAC Name: ethyl 3-amino-6-methylpyrazine-2-carboxylate
SYSTEMATIC NAME: ethyl 3-azanyl-6-methyl-pyrazine-2-carboxylate
MOLECULAR FORMULA: C8H11N3O2
MOLECULAR WEIGHT: 181.19184
SMILES: CCOC(=O)C1=NC(=CN=C1N)C
Structure:

CAS RN: 63662-83-9
CAS Name: 3-amino-5,6,7,8,9,10,11,12,13,14-decahydrocyclododeca[b]pyrazine-2-carbonitrile
OPENEYE Name: 3-amino-5,6,7,8,9,10,11,12,13,14-decahydrocyclododeca[b]pyrazine-2-carbonitrile
IUPAC Name: 3-amino-5,6,7,8,9,10,11,12,13,14-decahydrocyclododeca[b]pyrazine-2-carbonitrile
SYSTEMATIC NAME: 3-azanyl-5,6,7,8,9,10,11,12,13,14-decahydrocyclododeca[b]pyrazine-2-carbonitrile
MOLECULAR FORMULA: C15H22N4
MOLECULAR WEIGHT: 258.36198
SMILES: C1CCCCCC2=NC(=C(N=C2CCCC1)C#N)N
Structure:

CAS RN: 29111-46-4
CAS Name: 2-anilinoacetohydrazide
OPENEYE Name: 2-anilinoacetohydrazide
IUPAC Name: 2-anilinoacetohydrazide
SYSTEMATIC NAME: 2-phenylazanylethanehydrazide
MOLECULAR FORMULA: C8H11N3O
MOLECULAR WEIGHT: 165.19244
SMILES: C1=CC=C(C=C1)NCC(=O)NN
Structure:

CAS RN: 39550-24-8
CAS Name: 3,7-diphenyl-5-pyrimido[5,4-e][1,2,4]triazinamine
OPENEYE Name: 3,7-diphenylpyrimido[5,4-e][1,2,4]triazin-5-amine
IUPAC Name: 3,7-diphenylpyrimido[5,4-e][1,2,4]triazin-5-amine
SYSTEMATIC NAME: 3,7-diphenylpyrimido[5,4-e][1,2,4]triazin-5-amine
MOLECULAR FORMULA: C17H12N6
MOLECULAR WEIGHT: 300.31738
SMILES: C1=CC=C(C=C1)C2=NC3=C(N=C(N=C3N)C4=CC=CC=C4)N=N2
Structure:

CAS RN: 30720-39-9
CAS Name: N7-methyl-[1,2,5]oxadiazolo[3,4-d]pyrimidine-5,7-diamine
OPENEYE Name: N7-methyl-[1,2,5]oxadiazolo[3,4-d]pyrimidine-5,7-diamine
IUPAC Name: 7-N-methyl-[1,2,5]oxadiazolo[3,4-d]pyrimidine-5,7-diamine
SYSTEMATIC NAME: N7-methyl-[1,2,5]oxadiazolo[3,4-d]pyrimidine-5,7-diamine
MOLECULAR FORMULA: C5H6N6O
MOLECULAR WEIGHT: 166.14074
SMILES: CNC1=NC(=NC2=NON=C21)N
Structure:

CAS RN: 30708-67-9
CAS Name: N5,N5-dimethyl-[1,2,5]oxadiazolo[3,4-d]pyrimidine-5,7-diamine
OPENEYE Name: N5,N5-dimethyl-[1,2,5]oxadiazolo[3,4-d]pyrimidine-5,7-diamine
IUPAC Name: 5-N,5-N-dimethyl-[1,2,5]oxadiazolo[3,4-d]pyrimidine-5,7-diamine
SYSTEMATIC NAME: N5,N5-dimethyl-[1,2,5]oxadiazolo[3,4-d]pyrimidine-5,7-diamine
MOLECULAR FORMULA: C6H8N6O
MOLECULAR WEIGHT: 180.16732
SMILES: CN(C)C1=NC2=NON=C2C(=N1)N
Structure:

CAS RN: 53274-33-2
CAS Name: 6,7,8,9,10,11-hexahydrocycloocta[g]pteridine-2,4-diamine
OPENEYE Name: 6,7,8,9,10,11-hexahydrocycloocta[g]pteridine-2,4-diamine
IUPAC Name: 6,7,8,9,10,11-hexahydrocycloocta[g]pteridine-2,4-diamine
SYSTEMATIC NAME: 6,7,8,9,10,11-hexahydrocycloocta[g]pteridine-2,4-diamine
MOLECULAR FORMULA: C12H16N6
MOLECULAR WEIGHT: 244.29564
SMILES: C1CCCC2=NC3=C(C(=NC(=N3)N)N)N=C2CC1
Structure:

CAS RN: 68629-80-1
CAS Name: N-[6-[acetamido(methyl)amino]-2-amino-4-oxo-1H-pyrimidin-5-yl]-N-(ethoxycarbonylamino)carbamic acid ethyl ester
OPENEYE Name: ethyl N-[6-[acetamido(methyl)amino]-2-amino-4-oxo-1H-pyrimidin-5-yl]-N-(ethoxycarbonylamino)carbamate
IUPAC Name: ethyl N-[6-[acetamido(methyl)amino]-2-amino-4-oxo-1H-pyrimidin-5-yl]-N-(ethoxycarbonylamino)carbamate
SYSTEMATIC NAME: ethyl N-[6-[acetamido(methyl)amino]-2-azanyl-4-oxidanylidene-1H-pyrimidin-5-yl]-N-(ethoxycarbonylamino)carbamate
MOLECULAR FORMULA: C13H21N7O6
MOLECULAR WEIGHT: 371.34914
SMILES: CCOC(=O)NN(C1=C(NC(=NC1=O)N)N(C)NC(=O)C)C(=O)OCC
Structure:

CAS RN: 30745-07-4
CAS Name: [1,2,5]oxadiazolo[3,4-d]pyrimidine-5,7-diamine
OPENEYE Name: [1,2,5]oxadiazolo[3,4-d]pyrimidine-5,7-diamine
IUPAC Name: [1,2,5]oxadiazolo[3,4-d]pyrimidine-5,7-diamine
SYSTEMATIC NAME: [1,2,5]oxadiazolo[3,4-d]pyrimidine-5,7-diamine
MOLECULAR FORMULA: C4H4N6O
MOLECULAR WEIGHT: 152.11416
SMILES: C12=NON=C1N=C(N=C2N)N
Structure:

CAS RN: 52386-52-4
CAS Name: 2-amino-3-phenylpropanehydrazide
OPENEYE Name: 2-amino-3-phenyl-propanehydrazide
IUPAC Name: 2-amino-3-phenylpropanehydrazide
SYSTEMATIC NAME: 2-azanyl-3-phenyl-propanehydrazide
MOLECULAR FORMULA: C9H13N3O
MOLECULAR WEIGHT: 179.21902
SMILES: C1=CC=C(C=C1)CC(C(=O)NN)N
Structure:

CAS RN: 67873-21-6
CAS Name: 2-amino-6-[amino(methyl)amino]-1H-pyrimidin-4-one
OPENEYE Name: 2-amino-6-[amino(methyl)amino]-1H-pyrimidin-4-one
IUPAC Name: 2-amino-6-[amino(methyl)amino]-1H-pyrimidin-4-one
SYSTEMATIC NAME: 2-azanyl-6-[azanyl(methyl)amino]-1H-pyrimidin-4-one
MOLECULAR FORMULA: C5H9N5O
MOLECULAR WEIGHT: 155.15786
SMILES: CN(C1=CC(=O)N=C(N1)N)N
Structure:

CAS RN: 49810-02-8
CAS Name: N-(2,6-diamino-4-oxo-1H-pyrimidin-5-yl)-N-(ethoxycarbonylamino)carbamic acid ethyl ester
OPENEYE Name: ethyl N-(2,6-diamino-4-oxo-1H-pyrimidin-5-yl)-N-(ethoxycarbonylamino)carbamate
IUPAC Name: ethyl N-(2,6-diamino-4-oxo-1H-pyrimidin-5-yl)-N-(ethoxycarbonylamino)carbamate
SYSTEMATIC NAME: ethyl N-[2,6-bis(azanyl)-4-oxidanylidene-1H-pyrimidin-5-yl]-N-(ethoxycarbonylamino)carbamate
MOLECULAR FORMULA: C10H16N6O5
MOLECULAR WEIGHT: 300.27124
SMILES: CCOC(=O)NN(C1=C(NC(=NC1=O)N)N)C(=O)OCC
Structure:

CAS RN: 68629-79-8
CAS Name: N-[6-(acetylhydrazo)-2-amino-4-oxo-1H-pyrimidin-5-yl]-N-(ethoxycarbonylamino)carbamic acid ethyl ester
OPENEYE Name: ethyl N-[6-(2-acetylhydrazino)-2-amino-4-oxo-1H-pyrimidin-5-yl]-N-(ethoxycarbonylamino)carbamate
IUPAC Name: ethyl N-[6-(2-acetylhydrazinyl)-2-amino-4-oxo-1H-pyrimidin-5-yl]-N-(ethoxycarbonylamino)carbamate
SYSTEMATIC NAME: ethyl N-[2-azanyl-6-(2-ethanoylhydrazinyl)-4-oxidanylidene-1H-pyrimidin-5-yl]-N-(ethoxycarbonylamino)carbamate
MOLECULAR FORMULA: C12H19N7O6
MOLECULAR WEIGHT: 357.32256
SMILES: CCOC(=O)NN(C1=C(NC(=NC1=O)N)NNC(=O)C)C(=O)OCC
Structure:

CAS RN: 56183-53-0
CAS Name: (3,3-dimethyl-2-oxiranyl)-trimethylsilane
OPENEYE Name: (3,3-dimethyloxiran-2-yl)-trimethyl-silane
IUPAC Name: (3,3-dimethyloxiran-2-yl)-trimethylsilane
SYSTEMATIC NAME: (3,3-dimethyloxiran-2-yl)-trimethyl-silane
MOLECULAR FORMULA: C7H16OSi
MOLECULAR WEIGHT: 144.28684
SMILES: CC1(C(O1)[Si](C)(C)C)C
Structure:

CAS RN: 18292-39-2
CAS Name: trimethyl(2-methylprop-1-enyl)silane
OPENEYE Name: trimethyl(2-methylprop-1-enyl)silane
IUPAC Name: trimethyl(2-methylprop-1-enyl)silane
SYSTEMATIC NAME: trimethyl(2-methylprop-1-enyl)silane
MOLECULAR FORMULA: C7H16Si
MOLECULAR WEIGHT: 128.28744
SMILES: CC(=C[Si](C)(C)C)C
Structure:

CAS RN: 93007-79-5
CAS Name: N-[1-(4-methylphenyl)ethyl]benzamide
OPENEYE Name: N-[1-(p-tolyl)ethyl]benzamide
IUPAC Name: N-[1-(4-methylphenyl)ethyl]benzamide
SYSTEMATIC NAME: N-[1-(4-methylphenyl)ethyl]benzamide
MOLECULAR FORMULA: C16H17NO
MOLECULAR WEIGHT: 239.31228
SMILES: CC1=CC=C(C=C1)C(C)NC(=O)C2=CC=CC=C2
Structure:

CAS RN: 58280-91-4
CAS Name: (1-cyclopropyl-3-phenylpropyl)benzene
OPENEYE Name: (1-cyclopropyl-3-phenyl-propyl)benzene
IUPAC Name: (1-cyclopropyl-3-phenylpropyl)benzene
SYSTEMATIC NAME: (1-cyclopropyl-3-phenyl-propyl)benzene
MOLECULAR FORMULA: C18H20
MOLECULAR WEIGHT: 236.3514
SMILES: C1CC1C(CCC2=CC=CC=C2)C3=CC=CC=C3
Structure:

CAS RN: 58249-45-9
CAS Name: 1-tert-butyl-4-(cyclopropylmethyl)benzene
OPENEYE Name: 1-tert-butyl-4-(cyclopropylmethyl)benzene
IUPAC Name: 1-tert-butyl-4-(cyclopropylmethyl)benzene
SYSTEMATIC NAME: 1-tert-butyl-4-(cyclopropylmethyl)benzene
MOLECULAR FORMULA: C14H20
MOLECULAR WEIGHT: 188.3086
SMILES: CC(C)(C)C1=CC=C(C=C1)CC2CC2
Structure:

CAS RN: 30134-52-2
CAS Name: hex-5-en-2-ylbenzene
OPENEYE Name: 1-methylpent-4-enylbenzene
IUPAC Name: hex-5-en-2-ylbenzene
SYSTEMATIC NAME: hex-5-en-2-ylbenzene
MOLECULAR FORMULA: C12H16
MOLECULAR WEIGHT: 160.25544
SMILES: CC(CCC=C)C1=CC=CC=C1
Structure:

CAS RN: 53210-26-7
CAS Name: (2,6,6-trimethyl-1-cyclohexenyl)methylbenzene
OPENEYE Name: (2,6,6-trimethylcyclohexen-1-yl)methylbenzene
IUPAC Name: (2,6,6-trimethylcyclohexen-1-yl)methylbenzene
SYSTEMATIC NAME: (2,6,6-trimethylcyclohexen-1-yl)methylbenzene
MOLECULAR FORMULA: C16H22
MOLECULAR WEIGHT: 214.34588
SMILES: CC1=C(C(CCC1)(C)C)CC2=CC=CC=C2
Structure:

CAS RN: 16510-30-8
CAS Name: 1-cyclopropylethylbenzene
OPENEYE Name: 1-cyclopropylethylbenzene
IUPAC Name: 1-cyclopropylethylbenzene
SYSTEMATIC NAME: 1-cyclopropylethylbenzene
MOLECULAR FORMULA: C11H14
MOLECULAR WEIGHT: 146.22886
SMILES: CC(C1CC1)C2=CC=CC=C2
Structure:

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