2-(1,4-diazepan-1-yl)-N-[2-(4-methylphenyl)ethyl]pyridine-3-carboxamide

Systemtic Name: 2-(1,4-diazepan-1-yl)-N-[2-(4-methylphenyl)ethyl]pyridine-3-carboxamide Openeye Name: 2-(1,4-diazepan-1-yl)-N-[2-(p-tolyl)ethyl]pyridine-3-carboxamide CAS Name: 2-(1,4-diazepan-1-yl)-N-[2-(4-methylphenyl)ethyl]-3-pyridinecarboxamide IUPAC Name: 2-(1,4-diazepan-1-yl)-N-[2-(4-methylphenyl)ethyl]pyridine-3-carboxamide Traditional Name: 2-(1,4-diazepan-1-yl)-N-[2-(p-tolyl)ethyl]nicotinamide Formula: C20H26N4O MolecularWeight: 338.44664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CCNC(=O)C2=C(N=CC=C2)N3CCCNCC3

Isomeric SMILES

CC1=CC=C(C=C1)CCNC(=O)C2=C(N=CC=C2)N3CCCNCC3

InChI

InChI=1S/C20H26N4O/c1-16-5-7-17(8-6-16)9-12-23-20(25)18-4-2-11-22-19(18)24-14-3-10-21-13-15-24/h2,4-8,11,21H,3,9-10,12-15H2,1H3,(H,23,25)