5-[2-(3,4-dihydro-1H-isoquinolin-2-yl)quinolin-4-yl]-3-(3-methylphenyl)-1,2,4-oxadiazole

Systemtic Name: 5-[2-(3,4-dihydro-1H-isoquinolin-2-yl)quinolin-4-yl]-3-(3-methylphenyl)-1,2,4-oxadiazole Openeye Name: 5-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-4-quinolyl]-3-(m-tolyl)-1,2,4-oxadiazole CAS Name: 5-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-4-quinolinyl]-3-(3-methylphenyl)-1,2,4-oxadiazole IUPAC Name: 5-[2-(3,4-dihydro-1H-isoquinolin-2-yl)quinolin-4-yl]-3-(3-methylphenyl)-1,2,4-oxadiazole Traditional Name: 5-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-4-quinolyl]-3-(m-tolyl)-1,2,4-oxadiazole Formula: C27H22N4O MolecularWeight: 418.48978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NOC(=N2)C3=CC(=NC4=CC=CC=C43)N5CCC6=CC=CC=C6C5

Isomeric SMILES

CC1=CC=CC(=C1)C2=NOC(=N2)C3=CC(=NC4=CC=CC=C43)N5CCC6=CC=CC=C6C5

InChI

InChI=1S/C27H22N4O/c1-18-7-6-10-20(15-18)26-29-27(32-30-26)23-16-25(28-24-12-5-4-11-22(23)24)31-14-13-19-8-2-3-9-21(19)17-31/h2-12,15-16H,13-14,17H2,1H3