N-[3-(2-oxidanylideneazepan-1-yl)propyl]-2-pyridin-4-yl-quinoline-4-carboxamide

Systemtic Name: N-[3-(2-oxidanylideneazepan-1-yl)propyl]-2-pyridin-4-yl-quinoline-4-carboxamide Openeye Name: N-[3-(2-oxoazepan-1-yl)propyl]-2-(4-pyridyl)quinoline-4-carboxamide CAS Name: N-[3-(2-oxo-1-azepanyl)propyl]-2-pyridin-4-yl-4-quinolinecarboxamide IUPAC Name: N-[3-(2-oxoazepan-1-yl)propyl]-2-pyridin-4-ylquinoline-4-carboxamide Traditional Name: N-[3-(2-ketoazepan-1-yl)propyl]-2-(4-pyridyl)cinchoninamide Formula: C24H26N4O2 MolecularWeight: 402.48884

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(CC1)CCCNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=NC=C4

Isomeric SMILES

C1CCC(=O)N(CC1)CCCNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=NC=C4

InChI

InChI=1S/C24H26N4O2/c29-23-9-2-1-5-15-28(23)16-6-12-26-24(30)20-17-22(18-10-13-25-14-11-18)27-21-8-4-3-7-19(20)21/h3-4,7-8,10-11,13-14,17H,1-2,5-6,9,12,15-16H2,(H,26,30)