3-[(1-cyclopentyl-1,2,3,4-tetrazol-5-yl)-(3,4-dihydro-1H-isoquinolin-2-yl)methyl]-8-methyl-1H-quinolin-2-one

Systemtic Name: 3-[(1-cyclopentyl-1,2,3,4-tetrazol-5-yl)-(3,4-dihydro-1H-isoquinolin-2-yl)methyl]-8-methyl-1H-quinolin-2-one Openeye Name: 3-[(1-cyclopentyltetrazol-5-yl)-(3,4-dihydro-1H-isoquinolin-2-yl)methyl]-8-methyl-1H-quinolin-2-one CAS Name: 3-[(1-cyclopentyl-5-tetrazolyl)-(3,4-dihydro-1H-isoquinolin-2-yl)methyl]-8-methyl-1H-quinolin-2-one IUPAC Name: 3-[(1-cyclopentyltetrazol-5-yl)-(3,4-dihydro-1H-isoquinolin-2-yl)methyl]-8-methyl-1H-quinolin-2-one Traditional Name: 3-[(1-cyclopentyltetrazol-5-yl)-(3,4-dihydro-1H-isoquinolin-2-yl)methyl]-8-methyl-carbostyril Formula: C26H28N6O MolecularWeight: 440.54012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1NC(=O)C(=C2)C(C3=NN=NN3C4CCCC4)N5CCC6=CC=CC=C6C5

Isomeric SMILES

CC1=CC=CC2=C1NC(=O)C(=C2)C(C3=NN=NN3C4CCCC4)N5CCC6=CC=CC=C6C5

InChI

InChI=1S/C26H28N6O/c1-17-7-6-10-19-15-22(26(33)27-23(17)19)24(25-28-29-30-32(25)21-11-4-5-12-21)31-14-13-18-8-2-3-9-20(18)16-31/h2-3,6-10,15,21,24H,4-5,11-14,16H2,1H3,(H,27,33)