4-(3-sulfanyl-2H-1,2,3,4-tetrazol-4-yl)benzoic acid

Systemtic Name: 4-(3-sulfanyl-2H-1,2,3,4-tetrazol-4-yl)benzoic acid Openeye Name: 4-(3-sulfanyl-2H-tetrazol-4-yl)benzoic acid CAS Name: 4-(3-mercapto-2H-tetrazol-4-yl)benzoic acid IUPAC Name: 4-(3-sulfanyl-2H-tetrazol-4-yl)benzoic acid Traditional Name: 4-(3-mercapto-2H-tetrazol-4-yl)benzoic acid Formula: C8H8N4O2S MolecularWeight: 224.23972

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)N2C=NNN2S

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)N2C=NNN2S

InChI

InChI=1S/C8H8N4O2S/c13-8(14)6-1-3-7(4-2-6)11-5-9-10-12(11)15/h1-5,10,15H,(H,13,14)