4-(2H-1,2,3,4-tetrazol-5-ylsulfanyl)benzoic acid

Systemtic Name: 4-(2H-1,2,3,4-tetrazol-5-ylsulfanyl)benzoic acid Openeye Name: 4-(2H-tetrazol-5-ylsulfanyl)benzoic acid CAS Name: 4-(2H-tetrazol-5-ylthio)benzoic acid IUPAC Name: 4-(2H-tetrazol-5-ylsulfanyl)benzoic acid Traditional Name: 4-(2H-tetrazol-5-ylthio)benzoic acid Formula: C8H6N4O2S MolecularWeight: 222.22384

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)SC2=NNN=N2

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)SC2=NNN=N2

InChI

InChI=1S/C8H6N4O2S/c13-7(14)5-1-3-6(4-2-5)15-8-9-11-12-10-8/h1-4H,(H,13,14)(H,9,10,11,12)