2-(5-sulfanylidene-1H-1,2,4-triazol-4-yl)benzenesulfonic acid

Systemtic Name: 2-(5-sulfanylidene-1H-1,2,4-triazol-4-yl)benzenesulfonic acid Openeye Name: 2-(5-thioxo-1H-1,2,4-triazol-4-yl)benzenesulfonic acid CAS Name: 2-(5-sulfanylidene-1H-1,2,4-triazol-4-yl)benzenesulfonic acid IUPAC Name: 2-(5-sulfanylidene-1H-1,2,4-triazol-4-yl)benzenesulfonic acid Traditional Name: 2-(5-thioxo-1H-1,2,4-triazol-4-yl)besylic acid Formula: C8H7N3O3S2 MolecularWeight: 257.28948

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)N2C=NNC2=S)S(=O)(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)N2C=NNC2=S)S(=O)(=O)O

InChI

InChI=1S/C8H7N3O3S2/c12-16(13,14)7-4-2-1-3-6(7)11-5-9-10-8(11)15/h1-5H,(H,10,15)(H,12,13,14)