3-(3-methylphenyl)-5-[2-(4-phenylpiperazin-1-yl)quinolin-4-yl]-1,2,4-oxadiazole

Systemtic Name: 3-(3-methylphenyl)-5-[2-(4-phenylpiperazin-1-yl)quinolin-4-yl]-1,2,4-oxadiazole Openeye Name: 3-(m-tolyl)-5-[2-(4-phenylpiperazin-1-yl)-4-quinolyl]-1,2,4-oxadiazole CAS Name: 3-(3-methylphenyl)-5-[2-(4-phenyl-1-piperazinyl)-4-quinolinyl]-1,2,4-oxadiazole IUPAC Name: 3-(3-methylphenyl)-5-[2-(4-phenylpiperazin-1-yl)quinolin-4-yl]-1,2,4-oxadiazole Traditional Name: 3-(m-tolyl)-5-[2-(4-phenylpiperazino)-4-quinolyl]-1,2,4-oxadiazole Formula: C28H25N5O MolecularWeight: 447.531

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NOC(=N2)C3=CC(=NC4=CC=CC=C43)N5CCN(CC5)C6=CC=CC=C6

Isomeric SMILES

CC1=CC=CC(=C1)C2=NOC(=N2)C3=CC(=NC4=CC=CC=C43)N5CCN(CC5)C6=CC=CC=C6

InChI

InChI=1S/C28H25N5O/c1-20-8-7-9-21(18-20)27-30-28(34-31-27)24-19-26(29-25-13-6-5-12-23(24)25)33-16-14-32(15-17-33)22-10-3-2-4-11-22/h2-13,18-19H,14-17H2,1H3