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

Systemtic Name: N-(pyridin-3-ylmethyl)-1-(2-thiophen-2-ylquinolin-4-yl)carbonyl-piperidine-4-carboxamide Openeye Name: N-(3-pyridylmethyl)-1-[2-(2-thienyl)quinoline-4-carbonyl]piperidine-4-carboxamide CAS Name: 1-[oxo-(2-thiophen-2-yl-4-quinolinyl)methyl]-N-(3-pyridinylmethyl)-4-piperidinecarboxamide IUPAC Name: N-(pyridin-3-ylmethyl)-1-(2-thiophen-2-ylquinoline-4-carbonyl)piperidine-4-carboxamide Traditional Name: N-(3-pyridylmethyl)-1-[2-(2-thienyl)quinoline-4-carbonyl]isonipecotamide Formula: C26H24N4O2S MolecularWeight: 456.55936

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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=CC=CS5

Isomeric SMILES

C1CN(CCC1C(=O)NCC2=CN=CC=C2)C(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CS5

InChI

InChI=1S/C26H24N4O2S/c31-25(28-17-18-5-3-11-27-16-18)19-9-12-30(13-10-19)26(32)21-15-23(24-8-4-14-33-24)29-22-7-2-1-6-20(21)22/h1-8,11,14-16,19H,9-10,12-13,17H2,(H,28,31)