S-(1,2,3-benzothiadiazol-7-ylmethyl) ethanethioate

Systemtic Name: S-(1,2,3-benzothiadiazol-7-ylmethyl) ethanethioate Openeye Name: S-(1,2,3-benzothiadiazol-7-ylmethyl) ethanethioate CAS Name: ethanethioic acid S-(1,2,3-benzothiadiazol-7-ylmethyl) ester IUPAC Name: S-(1,2,3-benzothiadiazol-7-ylmethyl) ethanethioate Traditional Name: ethanethioic acid S-(1,2,3-benzothiadiazol-7-ylmethyl) ester Formula: C9H8N2OS2 MolecularWeight: 224.30262

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC1=C2C(=CC=C1)N=NS2

Isomeric SMILES

CC(=O)SCC1=C2C(=CC=C1)N=NS2

InChI

InChI=1S/C9H8N2OS2/c1-6(12)13-5-7-3-2-4-8-9(7)14-11-10-8/h2-4H,5H2,1H3