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

Systemtic Name: 4-(5-sulfanylidene-1H-1,2,4-triazol-4-yl)benzenesulfonate Openeye Name: 4-(5-thioxo-1H-1,2,4-triazol-4-yl)benzenesulfonate CAS Name: 4-(5-sulfanylidene-1H-1,2,4-triazol-4-yl)benzenesulfonate IUPAC Name: 4-(5-sulfanylidene-1H-1,2,4-triazol-4-yl)benzenesulfonate Traditional Name: 4-(5-thioxo-1H-1,2,4-triazol-4-yl)besylate Formula: C8H6N3O3S2- MolecularWeight: 256.28154

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N2C=NNC2=S)S(=O)(=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1N2C=NNC2=S)S(=O)(=O)[O-]

InChI

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