N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]-3-thiophen-3-yl-propanamide

Systemtic Name: N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]-3-thiophen-3-yl-propanamide Openeye Name: N-[6-(3-oxopiperazin-1-yl)-3-pyridyl]-3-(3-thienyl)propanamide CAS Name: N-[6-(3-oxo-1-piperazinyl)-3-pyridinyl]-3-(3-thiophenyl)propanamide IUPAC Name: N-[6-(3-oxopiperazin-1-yl)pyridin-3-yl]-3-thiophen-3-ylpropanamide Traditional Name: N-[6-(3-ketopiperazino)-3-pyridyl]-3-(3-thienyl)propionamide Formula: C16H18N4O2S MolecularWeight: 330.40472

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)C2=NC=C(C=C2)NC(=O)CCC3=CSC=C3

Isomeric SMILES

C1CN(CC(=O)N1)C2=NC=C(C=C2)NC(=O)CCC3=CSC=C3

InChI

InChI=1S/C16H18N4O2S/c21-15(4-1-12-5-8-23-11-12)19-13-2-3-14(18-9-13)20-7-6-17-16(22)10-20/h2-3,5,8-9,11H,1,4,6-7,10H2,(H,17,22)(H,19,21)