N-[2-(cyanomethylsulfanyl)phenyl]-2-(3-oxidanylidenepiperazin-1-yl)ethanamide

Systemtic Name: N-[2-(cyanomethylsulfanyl)phenyl]-2-(3-oxidanylidenepiperazin-1-yl)ethanamide Openeye Name: N-[2-(cyanomethylsulfanyl)phenyl]-2-(3-oxopiperazin-1-yl)acetamide CAS Name: N-[2-(cyanomethylthio)phenyl]-2-(3-oxo-1-piperazinyl)acetamide IUPAC Name: N-[2-(cyanomethylsulfanyl)phenyl]-2-(3-oxopiperazin-1-yl)acetamide Traditional Name: N-[2-(cyanomethylthio)phenyl]-2-(3-ketopiperazino)acetamide Formula: C14H16N4O2S MolecularWeight: 304.36744

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)CC(=O)NC2=CC=CC=C2SCC#N

Isomeric SMILES

C1CN(CC(=O)N1)CC(=O)NC2=CC=CC=C2SCC#N

InChI

InChI=1S/C14H16N4O2S/c15-5-8-21-12-4-2-1-3-11(12)17-14(20)10-18-7-6-16-13(19)9-18/h1-4H,6-10H2,(H,16,19)(H,17,20)