6-[4-(2-oxidanylidene-2-thiophen-2-yl-ethyl)piperazin-1-yl]pyridine-3-carbonitrile

Systemtic Name: 6-[4-(2-oxidanylidene-2-thiophen-2-yl-ethyl)piperazin-1-yl]pyridine-3-carbonitrile Openeye Name: 6-[4-[2-oxo-2-(2-thienyl)ethyl]piperazin-1-yl]pyridine-3-carbonitrile CAS Name: 6-[4-(2-oxo-2-thiophen-2-ylethyl)-1-piperazinyl]-3-pyridinecarbonitrile IUPAC Name: 6-[4-(2-oxo-2-thiophen-2-ylethyl)piperazin-1-yl]pyridine-3-carbonitrile Traditional Name: 6-[4-[2-keto-2-(2-thienyl)ethyl]piperazino]nicotinonitrile Formula: C16H16N4OS MolecularWeight: 312.38944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)C2=CC=CS2)C3=NC=C(C=C3)C#N

Isomeric SMILES

C1CN(CCN1CC(=O)C2=CC=CS2)C3=NC=C(C=C3)C#N

InChI

InChI=1S/C16H16N4OS/c17-10-13-3-4-16(18-11-13)20-7-5-19(6-8-20)12-14(21)15-2-1-9-22-15/h1-4,9,11H,5-8,12H2