Friday, June 29, 2012

http://ChemLookup.com Compounds




CAS RN: 75776-08-8
CAS Name: 1-(2-chloroethyl)-3-[(7S)-1,2,3-trimethoxy-10-(methylthio)-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl]urea
OPENEYE Name: 1-(2-chloroethyl)-3-[(7S)-1,2,3-trimethoxy-10-methylsulfanyl-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl]urea
IUPAC Name: 1-(2-chloroethyl)-3-[(7S)-1,2,3-trimethoxy-10-methylsulfanyl-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl]urea
SYSTEMATIC NAME: 1-(2-chloroethyl)-3-[(7S)-1,2,3-trimethoxy-10-methylsulfanyl-9-oxidanylidene-6,7-dihydro-5H-benzo[a]heptalen-7-yl]urea
MOLECULAR FORMULA: C23H27ClN2O5S
MOLECULAR WEIGHT: 478.98888
SMILES: COC1=C(C(=C2C(=C1)CC[C@@H](C3=CC(=O)C(=CC=C32)SC)NC(=O)NCCCl)OC)OC
Structure:

CAS RN: 746-69-0
CAS Name: 9,10-dimethoxy-3-(phenylmethyl)-1,3,4,6,7,11b-hexahydrobenzo[a]quinolizin-2-one
OPENEYE Name: 3-benzyl-9,10-dimethoxy-1,3,4,6,7,11b-hexahydrobenzo[a]quinolizin-2-one
IUPAC Name: 3-benzyl-9,10-dimethoxy-1,3,4,6,7,11b-hexahydrobenzo[a]quinolizin-2-one
SYSTEMATIC NAME: 9,10-dimethoxy-3-(phenylmethyl)-1,3,4,6,7,11b-hexahydrobenzo[a]quinolizin-2-one
MOLECULAR FORMULA: C22H25NO3
MOLECULAR WEIGHT: 351.4388
SMILES: COC1=C(C=C2C3CC(=O)C(CN3CCC2=C1)CC4=CC=CC=C4)OC
Structure:

CAS RN: 72156-66-2
CAS Name: N-[1-[(1-hydrazinyl-1-oxo-3-phenylpropan-2-yl)amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamic acid tert-butyl ester
OPENEYE Name: tert-butyl N-[2-[(1-benzyl-2-hydrazino-2-oxo-ethyl)amino]-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]carbamate
IUPAC Name: tert-butyl N-[1-[(1-hydrazinyl-1-oxo-3-phenylpropan-2-yl)amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamate
SYSTEMATIC NAME: tert-butyl N-[1-[(1-diazanyl-1-oxidanylidene-3-phenyl-propan-2-yl)amino]-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]carbamate
MOLECULAR FORMULA: C25H31N5O4
MOLECULAR WEIGHT: 465.54474
SMILES: CC(C)(C)OC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)NC(CC3=CC=CC=C3)C(=O)NN
Structure:

CAS RN: 72156-62-8
CAS Name: 2-[[3-(1H-indol-3-yl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxopropyl]amino]-3-phenylpropanoic acid methyl ester
OPENEYE Name: methyl 2-[[2-(tert-butoxycarbonylamino)-3-(1H-indol-3-yl)propanoyl]amino]-3-phenyl-propanoate
IUPAC Name: methyl 2-[[3-(1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]-3-phenylpropanoate
SYSTEMATIC NAME: methyl 2-[[3-(1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]-3-phenyl-propanoate
MOLECULAR FORMULA: C26H31N3O5
MOLECULAR WEIGHT: 465.54144
SMILES: CC(C)(C)OC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)NC(CC3=CC=CC=C3)C(=O)OC
Structure:

CAS RN: 5262-01-1
CAS Name: N-[1-[[1-hydrazinyl-4-(methylthio)-1-oxobutan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamic acid tert-butyl ester
OPENEYE Name: tert-butyl N-[2-[[1-(hydrazinecarbonyl)-3-methylsulfanyl-propyl]amino]-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]carbamate
IUPAC Name: tert-butyl N-[1-[(1-hydrazinyl-4-methylsulfanyl-1-oxobutan-2-yl)amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamate
SYSTEMATIC NAME: tert-butyl N-[1-[(1-diazanyl-4-methylsulfanyl-1-oxidanylidene-butan-2-yl)amino]-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]carbamate
MOLECULAR FORMULA: C21H31N5O4S
MOLECULAR WEIGHT: 449.56694
SMILES: CC(C)(C)OC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)NC(CCSC)C(=O)NN
Structure:

CAS RN: 5934-88-3
CAS Name: 2-[[3-(1H-indol-3-yl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxopropyl]amino]-4-(methylthio)butanoic acid methyl ester
OPENEYE Name: methyl 2-[[2-(tert-butoxycarbonylamino)-3-(1H-indol-3-yl)propanoyl]amino]-4-methylsulfanyl-butanoate
IUPAC Name: methyl 2-[[3-(1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]-4-methylsulfanylbutanoate
SYSTEMATIC NAME: methyl 2-[[3-(1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]-4-methylsulfanyl-butanoate
MOLECULAR FORMULA: C22H31N3O5S
MOLECULAR WEIGHT: 449.56364
SMILES: CC(C)(C)OC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)NC(CCSC)C(=O)OC
Structure:

CAS RN: 56500-44-8
CAS Name: 3-methyl-2-butenoic acid 2-(dimethylamino)ethyl ester
OPENEYE Name: 2-(dimethylamino)ethyl 3-methylbut-2-enoate
IUPAC Name: 2-(dimethylamino)ethyl 3-methylbut-2-enoate
SYSTEMATIC NAME: 2-(dimethylamino)ethyl 3-methylbut-2-enoate
MOLECULAR FORMULA: C9H17NO2
MOLECULAR WEIGHT: 171.23678
SMILES: CC(=CC(=O)OCCN(C)C)C
Structure:

CAS RN: 62875-53-0
CAS Name: 2,3-dicyano-3-(1-naphthalenyl)propanoic acid ethyl ester
OPENEYE Name: ethyl 2,3-dicyano-3-(1-naphthyl)propanoate
IUPAC Name: ethyl 2,3-dicyano-3-naphthalen-1-ylpropanoate
SYSTEMATIC NAME: ethyl 2,3-dicyano-3-naphthalen-1-yl-propanoate
MOLECULAR FORMULA: C17H14N2O2
MOLECULAR WEIGHT: 278.30526
SMILES: CCOC(=O)C(C#N)C(C#N)C1=CC=CC2=CC=CC=C21
Structure:

CAS RN: 72657-57-9
CAS Name: 6-bicyclo[5.1.0]octanol
OPENEYE Name: bicyclo[5.1.0]octan-6-ol
IUPAC Name: bicyclo[5.1.0]octan-6-ol
SYSTEMATIC NAME: bicyclo[5.1.0]octan-6-ol
MOLECULAR FORMULA: C8H14O
MOLECULAR WEIGHT: 126.19616
SMILES: C1CCC(C2CC2C1)O
Structure:

CAS RN: 58577-70-1
CAS Name: 2-ethyl-1-cyclopentanol
OPENEYE Name: 2-ethylcyclopentanol
IUPAC Name: 2-ethylcyclopentan-1-ol
SYSTEMATIC NAME: 2-ethylcyclopentan-1-ol
MOLECULAR FORMULA: C7H14O
MOLECULAR WEIGHT: 114.18546
SMILES: CCC1CCCC1O
Structure:

CAS RN: 3313-85-7
CAS Name: 6-bicyclo[3.1.0]hexanylmethanol
OPENEYE Name: 6-bicyclo[3.1.0]hexanylmethanol
IUPAC Name: 6-bicyclo[3.1.0]hexanylmethanol
SYSTEMATIC NAME: 6-bicyclo[3.1.0]hexanylmethanol
MOLECULAR FORMULA: C7H12O
MOLECULAR WEIGHT: 112.16958
SMILES: C1CC2C(C1)C2CO
Structure:

CAS RN: 6749-50-4
CAS Name: 7-spiro[2.4]heptanol
OPENEYE Name: spiro[2.4]heptan-7-ol
IUPAC Name: spiro[2.4]heptan-7-ol
SYSTEMATIC NAME: spiro[2.4]heptan-7-ol
MOLECULAR FORMULA: C7H12O
MOLECULAR WEIGHT: 112.16958
SMILES: C1CC(C2(C1)CC2)O
Structure:

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