N-[2-(1,3-benzodioxol-5-yl)ethyl]-6-(4-methylpiperazin-1-yl)pyridine-3-carboxamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-6-(4-methylpiperazin-1-yl)pyridine-3-carboxamide Openeye Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-6-(4-methylpiperazin-1-yl)pyridine-3-carboxamide CAS Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-6-(4-methyl-1-piperazinyl)-3-pyridinecarboxamide IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-6-(4-methylpiperazin-1-yl)pyridine-3-carboxamide Traditional Name: N-homopiperonyl-6-(4-methylpiperazino)nicotinamide Formula: C20H24N4O3 MolecularWeight: 368.42956

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC=C(C=C2)C(=O)NCCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CN1CCN(CC1)C2=NC=C(C=C2)C(=O)NCCC3=CC4=C(C=C3)OCO4

InChI

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