sodium 3-(5-sulfanylidene-2H-1,2,3,4-tetrazol-1-yl)benzenesulfonate

Systemtic Name: sodium 3-(5-sulfanylidene-2H-1,2,3,4-tetrazol-1-yl)benzenesulfonate Openeye Name: sodium 3-(5-thioxo-2H-tetrazol-1-yl)benzenesulfonate CAS Name: sodium 3-(5-sulfanylidene-2H-tetrazol-1-yl)benzenesulfonate IUPAC Name: sodium 3-(5-sulfanylidene-2H-tetrazol-1-yl)benzenesulfonate Traditional Name: sodium 3-(5-thioxo-2H-tetrazol-1-yl)besylate Formula: C7H5N4NaO3S2 MolecularWeight: 280.25937

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)[O-])N2C(=S)N=NN2.[Na+]

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)[O-])N2C(=S)N=NN2.[Na+]

InChI

InChI=1S/C7H6N4O3S2.Na/c12-16(13,14)6-3-1-2-5(4-6)11-7(15)8-9-10-11;/h1-4H,(H,8,10,15)(H,12,13,14);/q;+1/p-1