2-[4-(4-methoxyphenyl)piperazin-1-yl]-N-(pyridin-4-ylmethyl)quinoline-4-carboxamide

Systemtic Name: 2-[4-(4-methoxyphenyl)piperazin-1-yl]-N-(pyridin-4-ylmethyl)quinoline-4-carboxamide Openeye Name: 2-[4-(4-methoxyphenyl)piperazin-1-yl]-N-(4-pyridylmethyl)quinoline-4-carboxamide CAS Name: 2-[4-(4-methoxyphenyl)-1-piperazinyl]-N-(pyridin-4-ylmethyl)-4-quinolinecarboxamide IUPAC Name: 2-[4-(4-methoxyphenyl)piperazin-1-yl]-N-(pyridin-4-ylmethyl)quinoline-4-carboxamide Traditional Name: 2-[4-(4-methoxyphenyl)piperazino]-N-(4-pyridylmethyl)cinchoninamide Formula: C27H27N5O2 MolecularWeight: 453.53558

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)C3=NC4=CC=CC=C4C(=C3)C(=O)NCC5=CC=NC=C5

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)C3=NC4=CC=CC=C4C(=C3)C(=O)NCC5=CC=NC=C5

InChI

InChI=1S/C27H27N5O2/c1-34-22-8-6-21(7-9-22)31-14-16-32(17-15-31)26-18-24(23-4-2-3-5-25(23)30-26)27(33)29-19-20-10-12-28-13-11-20/h2-13,18H,14-17,19H2,1H3,(H,29,33)