6-(2-ethyl-3-oxidanylidene-piperazin-1-yl)-N-[3-(4-methoxyphenyl)propyl]pyridine-3-carboxamide

Systemtic Name: 6-(2-ethyl-3-oxidanylidene-piperazin-1-yl)-N-[3-(4-methoxyphenyl)propyl]pyridine-3-carboxamide Openeye Name: 6-(2-ethyl-3-oxo-piperazin-1-yl)-N-[3-(4-methoxyphenyl)propyl]pyridine-3-carboxamide CAS Name: 6-(2-ethyl-3-oxo-1-piperazinyl)-N-[3-(4-methoxyphenyl)propyl]-3-pyridinecarboxamide IUPAC Name: 6-(2-ethyl-3-oxopiperazin-1-yl)-N-[3-(4-methoxyphenyl)propyl]pyridine-3-carboxamide Traditional Name: 6-(2-ethyl-3-keto-piperazino)-N-[3-(4-methoxyphenyl)propyl]nicotinamide Formula: C22H28N4O3 MolecularWeight: 396.48272

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)NCCN1C2=NC=C(C=C2)C(=O)NCCCC3=CC=C(C=C3)OC

Isomeric SMILES

CCC1C(=O)NCCN1C2=NC=C(C=C2)C(=O)NCCCC3=CC=C(C=C3)OC

InChI

InChI=1S/C22H28N4O3/c1-3-19-22(28)24-13-14-26(19)20-11-8-17(15-25-20)21(27)23-12-4-5-16-6-9-18(29-2)10-7-16/h6-11,15,19H,3-5,12-14H2,1-2H3,(H,23,27)(H,24,28)