4-cyano-N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]benzamide

Systemtic Name: 4-cyano-N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]benzamide Openeye Name: 4-cyano-N-[6-(3-oxopiperazin-1-yl)-3-pyridyl]benzamide CAS Name: 4-cyano-N-[6-(3-oxo-1-piperazinyl)-3-pyridinyl]benzamide IUPAC Name: 4-cyano-N-[6-(3-oxopiperazin-1-yl)pyridin-3-yl]benzamide Traditional Name: 4-cyano-N-[6-(3-ketopiperazino)-3-pyridyl]benzamide Formula: C17H15N5O2 MolecularWeight: 321.3333

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)C2=NC=C(C=C2)NC(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

C1CN(CC(=O)N1)C2=NC=C(C=C2)NC(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C17H15N5O2/c18-9-12-1-3-13(4-2-12)17(24)21-14-5-6-15(20-10-14)22-8-7-19-16(23)11-22/h1-6,10H,7-8,11H2,(H,19,23)(H,21,24)