N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-(3-methylpiperazin-1-yl)pyridine-3-carboxamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-(3-methylpiperazin-1-yl)pyridine-3-carboxamide Openeye Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-(3-methylpiperazin-1-yl)pyridine-3-carboxamide CAS Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-(3-methyl-1-piperazinyl)-3-pyridinecarboxamide IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-(3-methylpiperazin-1-yl)pyridine-3-carboxamide Traditional Name: N-homopiperonyl-2-(3-methylpiperazino)nicotinamide Formula: C20H24N4O3 MolecularWeight: 368.42956

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1)C2=C(C=CC=N2)C(=O)NCCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1CN(CCN1)C2=C(C=CC=N2)C(=O)NCCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H24N4O3/c1-14-12-24(10-9-21-14)19-16(3-2-7-22-19)20(25)23-8-6-15-4-5-17-18(11-15)27-13-26-17/h2-5,7,11,14,21H,6,8-10,12-13H2,1H3,(H,23,25)