N-[2-(pyridin-2-ylmethylsulfanyl)ethylcarbamothioyl]benzamide

Systemtic Name: N-[2-(pyridin-2-ylmethylsulfanyl)ethylcarbamothioyl]benzamide Openeye Name: N-[2-(2-pyridylmethylsulfanyl)ethylcarbamothioyl]benzamide CAS Name: N-[[2-(2-pyridinylmethylthio)ethylamino]-sulfanylidenemethyl]benzamide IUPAC Name: N-[2-(pyridin-2-ylmethylsulfanyl)ethylcarbamothioyl]benzamide Traditional Name: N-[2-(2-pyridylmethylthio)ethylthiocarbamoyl]benzamide Formula: C16H17N3OS2 MolecularWeight: 331.45568

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC(=S)NCCSCC2=CC=CC=N2

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC(=S)NCCSCC2=CC=CC=N2

InChI

InChI=1S/C16H17N3OS2/c20-15(13-6-2-1-3-7-13)19-16(21)18-10-11-22-12-14-8-4-5-9-17-14/h1-9H,10-12H2,(H2,18,19,20,21)