2-(3-methylphenyl)-N-(4-methylpiperazin-1-yl)quinoline-4-carboxamide

Systemtic Name: 2-(3-methylphenyl)-N-(4-methylpiperazin-1-yl)quinoline-4-carboxamide Openeye Name: N-(4-methylpiperazin-1-yl)-2-(m-tolyl)quinoline-4-carboxamide CAS Name: 2-(3-methylphenyl)-N-(4-methyl-1-piperazinyl)-4-quinolinecarboxamide IUPAC Name: 2-(3-methylphenyl)-N-(4-methylpiperazin-1-yl)quinoline-4-carboxamide Traditional Name: N-(4-methylpiperazino)-2-(m-tolyl)cinchoninamide Formula: C22H24N4O MolecularWeight: 360.45216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NN4CCN(CC4)C

Isomeric SMILES

CC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NN4CCN(CC4)C

InChI

InChI=1S/C22H24N4O/c1-16-6-5-7-17(14-16)21-15-19(18-8-3-4-9-20(18)23-21)22(27)24-26-12-10-25(2)11-13-26/h3-9,14-15H,10-13H2,1-2H3,(H,24,27)