2-(4-ethylpiperazin-1-yl)-2-pyridin-3-yl-ethanethioamide

Systemtic Name: 2-(4-ethylpiperazin-1-yl)-2-pyridin-3-yl-ethanethioamide Openeye Name: 2-(4-ethylpiperazin-1-yl)-2-(3-pyridyl)thioacetamide CAS Name: 2-(4-ethyl-1-piperazinyl)-2-(3-pyridinyl)ethanethioamide IUPAC Name: 2-(4-ethylpiperazin-1-yl)-2-pyridin-3-ylethanethioamide Traditional Name: 2-(4-ethylpiperazino)-2-(3-pyridyl)thioacetamide Formula: C13H20N4S MolecularWeight: 264.3897

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C(C2=CN=CC=C2)C(=S)N

Isomeric SMILES

CCN1CCN(CC1)C(C2=CN=CC=C2)C(=S)N

InChI

InChI=1S/C13H20N4S/c1-2-16-6-8-17(9-7-16)12(13(14)18)11-4-3-5-15-10-11/h3-5,10,12H,2,6-9H2,1H3,(H2,14,18)