N-(pyridin-3-ylmethyl)-1-(2-pyridin-3-ylquinolin-4-yl)carbonyl-piperidine-4-carboxamide

Systemtic Name: N-(pyridin-3-ylmethyl)-1-(2-pyridin-3-ylquinolin-4-yl)carbonyl-piperidine-4-carboxamide Openeye Name: N-(3-pyridylmethyl)-1-[2-(3-pyridyl)quinoline-4-carbonyl]piperidine-4-carboxamide CAS Name: 1-[oxo-[2-(3-pyridinyl)-4-quinolinyl]methyl]-N-(3-pyridinylmethyl)-4-piperidinecarboxamide IUPAC Name: N-(pyridin-3-ylmethyl)-1-(2-pyridin-3-ylquinoline-4-carbonyl)piperidine-4-carboxamide Traditional Name: N-(3-pyridylmethyl)-1-[2-(3-pyridyl)quinoline-4-carbonyl]isonipecotamide Formula: C27H25N5O2 MolecularWeight: 451.5197

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCC2=CN=CC=C2)C(=O)C3=CC(=NC4=CC=CC=C43)C5=CN=CC=C5

Isomeric SMILES

C1CN(CCC1C(=O)NCC2=CN=CC=C2)C(=O)C3=CC(=NC4=CC=CC=C43)C5=CN=CC=C5

InChI

InChI=1S/C27H25N5O2/c33-26(30-17-19-5-3-11-28-16-19)20-9-13-32(14-10-20)27(34)23-15-25(21-6-4-12-29-18-21)31-24-8-2-1-7-22(23)24/h1-8,11-12,15-16,18,20H,9-10,13-14,17H2,(H,30,33)