5-(5-sulfanylidene-2H-1,2,3,4-tetrazol-1-yl)-3H-2-benzofuran-1-one

Systemtic Name: 5-(5-sulfanylidene-2H-1,2,3,4-tetrazol-1-yl)-3H-2-benzofuran-1-one Openeye Name: 5-(5-thioxo-2H-tetrazol-1-yl)-3H-isobenzofuran-1-one CAS Name: 5-(5-sulfanylidene-2H-tetrazol-1-yl)-3H-isobenzofuran-1-one IUPAC Name: 5-(5-sulfanylidene-2H-tetrazol-1-yl)-3H-2-benzofuran-1-one Traditional Name: 5-(5-thioxo-2H-tetrazol-1-yl)phthalide Formula: C9H6N4O2S MolecularWeight: 234.23454

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=CC(=C2)N3C(=S)N=NN3)C(=O)O1

Isomeric SMILES

C1C2=C(C=CC(=C2)N3C(=S)N=NN3)C(=O)O1

InChI

InChI=1S/C9H6N4O2S/c14-8-7-2-1-6(3-5(7)4-15-8)13-9(16)10-11-12-13/h1-3H,4H2,(H,10,12,16)