N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]-2-phenyl-butanamide

Systemtic Name: N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]-2-phenyl-butanamide Openeye Name: N-[6-(3-oxopiperazin-1-yl)-3-pyridyl]-2-phenyl-butanamide CAS Name: N-[6-(3-oxo-1-piperazinyl)-3-pyridinyl]-2-phenylbutanamide IUPAC Name: N-[6-(3-oxopiperazin-1-yl)pyridin-3-yl]-2-phenylbutanamide Traditional Name: N-[6-(3-ketopiperazino)-3-pyridyl]-2-phenyl-butyramide Formula: C19H22N4O2 MolecularWeight: 338.40358

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)NC2=CN=C(C=C2)N3CCNC(=O)C3

Isomeric SMILES

CCC(C1=CC=CC=C1)C(=O)NC2=CN=C(C=C2)N3CCNC(=O)C3

InChI

InChI=1S/C19H22N4O2/c1-2-16(14-6-4-3-5-7-14)19(25)22-15-8-9-17(21-12-15)23-11-10-20-18(24)13-23/h3-9,12,16H,2,10-11,13H2,1H3,(H,20,24)(H,22,25)