6-(1,4-diazepan-1-yl)-N-(4-phenylbutyl)pyridine-3-carboxamide

Systemtic Name: 6-(1,4-diazepan-1-yl)-N-(4-phenylbutyl)pyridine-3-carboxamide Openeye Name: 6-(1,4-diazepan-1-yl)-N-(4-phenylbutyl)pyridine-3-carboxamide CAS Name: 6-(1,4-diazepan-1-yl)-N-(4-phenylbutyl)-3-pyridinecarboxamide IUPAC Name: 6-(1,4-diazepan-1-yl)-N-(4-phenylbutyl)pyridine-3-carboxamide Traditional Name: 6-(1,4-diazepan-1-yl)-N-(4-phenylbutyl)nicotinamide Formula: C21H28N4O MolecularWeight: 352.47322

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)C2=NC=C(C=C2)C(=O)NCCCCC3=CC=CC=C3

Isomeric SMILES

C1CNCCN(C1)C2=NC=C(C=C2)C(=O)NCCCCC3=CC=CC=C3

InChI

InChI=1S/C21H28N4O/c26-21(23-13-5-4-9-18-7-2-1-3-8-18)19-10-11-20(24-17-19)25-15-6-12-22-14-16-25/h1-3,7-8,10-11,17,22H,4-6,9,12-16H2,(H,23,26)