N-[2-(azepan-1-yl)ethyl]-2-pyridin-4-yl-quinoline-4-carboxamide

Systemtic Name: N-[2-(azepan-1-yl)ethyl]-2-pyridin-4-yl-quinoline-4-carboxamide Openeye Name: N-[2-(azepan-1-yl)ethyl]-2-(4-pyridyl)quinoline-4-carboxamide CAS Name: N-[2-(1-azepanyl)ethyl]-2-pyridin-4-yl-4-quinolinecarboxamide IUPAC Name: N-[2-(azepan-1-yl)ethyl]-2-pyridin-4-ylquinoline-4-carboxamide Traditional Name: N-[2-(azepan-1-yl)ethyl]-2-(4-pyridyl)cinchoninamide Formula: C23H26N4O MolecularWeight: 374.47874

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CCNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=NC=C4

Isomeric SMILES

C1CCCN(CC1)CCNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=NC=C4

InChI

InChI=1S/C23H26N4O/c28-23(25-13-16-27-14-5-1-2-6-15-27)20-17-22(18-9-11-24-12-10-18)26-21-8-4-3-7-19(20)21/h3-4,7-12,17H,1-2,5-6,13-16H2,(H,25,28)