6-(azepan-1-yl)-N-quinolin-3-yl-pyridine-3-carboxamide

Systemtic Name: 6-(azepan-1-yl)-N-quinolin-3-yl-pyridine-3-carboxamide Openeye Name: 6-(azepan-1-yl)-N-(3-quinolyl)pyridine-3-carboxamide CAS Name: 6-(1-azepanyl)-N-(3-quinolinyl)-3-pyridinecarboxamide IUPAC Name: 6-(azepan-1-yl)-N-quinolin-3-ylpyridine-3-carboxamide Traditional Name: 6-(azepan-1-yl)-N-(3-quinolyl)nicotinamide Formula: C21H22N4O MolecularWeight: 346.42558

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=NC=C(C=C2)C(=O)NC3=CC4=CC=CC=C4N=C3

Isomeric SMILES

C1CCCN(CC1)C2=NC=C(C=C2)C(=O)NC3=CC4=CC=CC=C4N=C3

InChI

InChI=1S/C21H22N4O/c26-21(24-18-13-16-7-3-4-8-19(16)22-15-18)17-9-10-20(23-14-17)25-11-5-1-2-6-12-25/h3-4,7-10,13-15H,1-2,5-6,11-12H2,(H,24,26)