3-[[[(1S)-1-(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)propyl]-(phenylmethyl)amino]methyl]-6,7-dimethyl-1H-quinolin-2-one

Systemtic Name: 3-[[[(1S)-1-(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)propyl]-(phenylmethyl)amino]methyl]-6,7-dimethyl-1H-quinolin-2-one Openeye Name: 3-[[benzyl-[(1S)-1-(1-cyclohexyltetrazol-5-yl)propyl]amino]methyl]-6,7-dimethyl-1H-quinolin-2-one CAS Name: 3-[[[(1S)-1-(1-cyclohexyl-5-tetrazolyl)propyl]-(phenylmethyl)amino]methyl]-6,7-dimethyl-1H-quinolin-2-one IUPAC Name: 3-[[benzyl-[(1S)-1-(1-cyclohexyltetrazol-5-yl)propyl]amino]methyl]-6,7-dimethyl-1H-quinolin-2-one Traditional Name: 3-[[benzyl-[(1S)-1-(1-cyclohexyltetrazol-5-yl)propyl]amino]methyl]-6,7-dimethyl-carbostyril Formula: C29H36N6O MolecularWeight: 484.63574

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NN=NN1C2CCCCC2)N(CC3=CC=CC=C3)CC4=CC5=CC(=C(C=C5NC4=O)C)C

Isomeric SMILES

CC[C@@H](C1=NN=NN1C2CCCCC2)N(CC3=CC=CC=C3)CC4=CC5=CC(=C(C=C5NC4=O)C)C

InChI

InChI=1S/C29H36N6O/c1-4-27(28-31-32-33-35(28)25-13-9-6-10-14-25)34(18-22-11-7-5-8-12-22)19-24-17-23-15-20(2)21(3)16-26(23)30-29(24)36/h5,7-8,11-12,15-17,25,27H,4,6,9-10,13-14,18-19H2,1-3H3,(H,30,36)/t27-/m0/s1