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

Systemtic Name: 5-[2-(3,4-dihydro-1H-isoquinolin-2-yl)quinolin-4-yl]-3-phenyl-1,2,4-oxadiazole Openeye Name: 5-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-4-quinolyl]-3-phenyl-1,2,4-oxadiazole CAS Name: 5-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-4-quinolinyl]-3-phenyl-1,2,4-oxadiazole IUPAC Name: 5-[2-(3,4-dihydro-1H-isoquinolin-2-yl)quinolin-4-yl]-3-phenyl-1,2,4-oxadiazole Traditional Name: 5-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-4-quinolyl]-3-phenyl-1,2,4-oxadiazole Formula: C26H20N4O MolecularWeight: 404.4632

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C3=NC4=CC=CC=C4C(=C3)C5=NC(=NO5)C6=CC=CC=C6

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C3=NC4=CC=CC=C4C(=C3)C5=NC(=NO5)C6=CC=CC=C6

InChI

InChI=1S/C26H20N4O/c1-2-9-19(10-3-1)25-28-26(31-29-25)22-16-24(27-23-13-7-6-12-21(22)23)30-15-14-18-8-4-5-11-20(18)17-30/h1-13,16H,14-15,17H2