S-[2-(1,2,3,4-tetrazol-1-yl)ethyl] ethanethioate

Systemtic Name: S-[2-(1,2,3,4-tetrazol-1-yl)ethyl] ethanethioate Openeye Name: S-[2-(tetrazol-1-yl)ethyl] ethanethioate CAS Name: ethanethioic acid S-[2-(1-tetrazolyl)ethyl] ester IUPAC Name: S-[2-(tetrazol-1-yl)ethyl] ethanethioate Traditional Name: ethanethioic acid S-[2-(tetrazol-1-yl)ethyl] ester Formula: C5H8N4OS MolecularWeight: 172.20822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCCN1C=NN=N1

Isomeric SMILES

CC(=O)SCCN1C=NN=N1

InChI

InChI=1S/C5H8N4OS/c1-5(10)11-3-2-9-4-6-7-8-9/h4H,2-3H2,1H3