2-(4-methylphenyl)-N-[[6-(4-methylpiperazin-1-yl)pyridin-3-yl]methyl]quinoline-4-carboxamide

Systemtic Name: 2-(4-methylphenyl)-N-[[6-(4-methylpiperazin-1-yl)pyridin-3-yl]methyl]quinoline-4-carboxamide Openeye Name: N-[[6-(4-methylpiperazin-1-yl)-3-pyridyl]methyl]-2-(p-tolyl)quinoline-4-carboxamide CAS Name: 2-(4-methylphenyl)-N-[[6-(4-methyl-1-piperazinyl)-3-pyridinyl]methyl]-4-quinolinecarboxamide IUPAC Name: 2-(4-methylphenyl)-N-[[6-(4-methylpiperazin-1-yl)pyridin-3-yl]methyl]quinoline-4-carboxamide Traditional Name: N-[[6-(4-methylpiperazino)-3-pyridyl]methyl]-2-(p-tolyl)cinchoninamide Formula: C28H29N5O MolecularWeight: 451.56276

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCC4=CN=C(C=C4)N5CCN(CC5)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCC4=CN=C(C=C4)N5CCN(CC5)C

InChI

InChI=1S/C28H29N5O/c1-20-7-10-22(11-8-20)26-17-24(23-5-3-4-6-25(23)31-26)28(34)30-19-21-9-12-27(29-18-21)33-15-13-32(2)14-16-33/h3-12,17-18H,13-16,19H2,1-2H3,(H,30,34)