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

Systemtic Name: 3-[[[(1S)-1-(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)propyl]-phenethyl-amino]methyl]-6,7-dimethyl-1H-quinolin-2-one Openeye Name: 3-[[[(1S)-1-(1-cyclohexyltetrazol-5-yl)propyl]-phenethyl-amino]methyl]-6,7-dimethyl-1H-quinolin-2-one CAS Name: 3-[[[(1S)-1-(1-cyclohexyl-5-tetrazolyl)propyl]-phenethylamino]methyl]-6,7-dimethyl-1H-quinolin-2-one IUPAC Name: 3-[[[(1S)-1-(1-cyclohexyltetrazol-5-yl)propyl]-phenethylamino]methyl]-6,7-dimethyl-1H-quinolin-2-one Traditional Name: 3-[[[(1S)-1-(1-cyclohexyltetrazol-5-yl)propyl]-phenethyl-amino]methyl]-6,7-dimethyl-carbostyril Formula: C30H38N6O MolecularWeight: 498.66232

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NN=NN1C2CCCCC2)N(CCC3=CC=CC=C3)CC4=CC5=CC(=C(C=C5NC4=O)C)C

Isomeric SMILES

CC[C@@H](C1=NN=NN1C2CCCCC2)N(CCC3=CC=CC=C3)CC4=CC5=CC(=C(C=C5NC4=O)C)C

InChI

InChI=1S/C30H38N6O/c1-4-28(29-32-33-34-36(29)26-13-9-6-10-14-26)35(16-15-23-11-7-5-8-12-23)20-25-19-24-17-21(2)22(3)18-27(24)31-30(25)37/h5,7-8,11-12,17-19,26,28H,4,6,9-10,13-16,20H2,1-3H3,(H,31,37)/t28-/m0/s1