3-[(1-cyclohexyl-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-cyclohexyl-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-cyclohexyltetrazol-5-yl)-(3,4-dihydro-1H-isoquinolin-2-yl)methyl]-8-methyl-1H-quinolin-2-one CAS Name: 3-[(1-cyclohexyl-5-tetrazolyl)-(3,4-dihydro-1H-isoquinolin-2-yl)methyl]-8-methyl-1H-quinolin-2-one IUPAC Name: 3-[(1-cyclohexyltetrazol-5-yl)-(3,4-dihydro-1H-isoquinolin-2-yl)methyl]-8-methyl-1H-quinolin-2-one Traditional Name: 3-[(1-cyclohexyltetrazol-5-yl)-(3,4-dihydro-1H-isoquinolin-2-yl)methyl]-8-methyl-carbostyril Formula: C27H30N6O MolecularWeight: 454.5667

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1NC(=O)C(=C2)C(C3=NN=NN3C4CCCCC4)N5CCC6=CC=CC=C6C5

Isomeric SMILES

CC1=CC=CC2=C1NC(=O)C(=C2)C(C3=NN=NN3C4CCCCC4)N5CCC6=CC=CC=C6C5

InChI

InChI=1S/C27H30N6O/c1-18-8-7-11-20-16-23(27(34)28-24(18)20)25(32-15-14-19-9-5-6-10-21(19)17-32)26-29-30-31-33(26)22-12-3-2-4-13-22/h5-11,16,22,25H,2-4,12-15,17H2,1H3,(H,28,34)