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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NN=NN1C2CCCC2)N(CCC3=CC=CC=C3)CC4=CC5=CC(=C(C=C5NC4=O)C)C

Isomeric SMILES

CC[C@@H](C1=NN=NN1C2CCCC2)N(CCC3=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)25-12-8-9-13-25)34(15-14-22-10-6-5-7-11-22)19-24-18-23-16-20(2)21(3)17-26(23)30-29(24)36/h5-7,10-11,16-18,25,27H,4,8-9,12-15,19H2,1-3H3,(H,30,36)/t27-/m0/s1