N-[3-[3-(2-oxidanylideneazepan-1-yl)propylcarbamoyl]phenyl]pyridine-3-carboxamide

Systemtic Name: N-[3-[3-(2-oxidanylideneazepan-1-yl)propylcarbamoyl]phenyl]pyridine-3-carboxamide Openeye Name: N-[3-[3-(2-oxoazepan-1-yl)propylcarbamoyl]phenyl]pyridine-3-carboxamide CAS Name: N-[3-[oxo-[3-(2-oxo-1-azepanyl)propylamino]methyl]phenyl]-3-pyridinecarboxamide IUPAC Name: N-[3-[3-(2-oxoazepan-1-yl)propylcarbamoyl]phenyl]pyridine-3-carboxamide Traditional Name: N-[3-[3-(2-ketoazepan-1-yl)propylcarbamoyl]phenyl]nicotinamide Formula: C22H26N4O3 MolecularWeight: 394.46684

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(CC1)CCCNC(=O)C2=CC(=CC=C2)NC(=O)C3=CN=CC=C3

Isomeric SMILES

C1CCC(=O)N(CC1)CCCNC(=O)C2=CC(=CC=C2)NC(=O)C3=CN=CC=C3

InChI

InChI=1S/C22H26N4O3/c27-20-10-2-1-3-13-26(20)14-6-12-24-21(28)17-7-4-9-19(15-17)25-22(29)18-8-5-11-23-16-18/h4-5,7-9,11,15-16H,1-3,6,10,12-14H2,(H,24,28)(H,25,29)