[4-(5-sulfanylidene-2H-1,2,3,4-tetrazol-1-yl)phenyl]methanesulfonic acid

Systemtic Name: [4-(5-sulfanylidene-2H-1,2,3,4-tetrazol-1-yl)phenyl]methanesulfonic acid Openeye Name: [4-(5-thioxo-2H-tetrazol-1-yl)phenyl]methanesulfonic acid CAS Name: [4-(5-sulfanylidene-2H-tetrazol-1-yl)phenyl]methanesulfonic acid IUPAC Name: [4-(5-sulfanylidene-2H-tetrazol-1-yl)phenyl]methanesulfonic acid Traditional Name: [4-(5-thioxo-2H-tetrazol-1-yl)phenyl]methanesulfonic acid Formula: C8H8N4O3S2 MolecularWeight: 272.30412

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CS(=O)(=O)O)N2C(=S)N=NN2

Isomeric SMILES

C1=CC(=CC=C1CS(=O)(=O)O)N2C(=S)N=NN2

InChI

InChI=1S/C8H8N4O3S2/c13-17(14,15)5-6-1-3-7(4-2-6)12-8(16)9-10-11-12/h1-4H,5H2,(H,9,11,16)(H,13,14,15)