4-(3-methylsulfanyl-2H-1,2,3,4-tetrazol-4-yl)benzenesulfonate

Systemtic Name: 4-(3-methylsulfanyl-2H-1,2,3,4-tetrazol-4-yl)benzenesulfonate Openeye Name: 4-(3-methylsulfanyl-2H-tetrazol-4-yl)benzenesulfonate CAS Name: 4-[3-(methylthio)-2H-tetrazol-4-yl]benzenesulfonate IUPAC Name: 4-(3-methylsulfanyl-2H-tetrazol-4-yl)benzenesulfonate Traditional Name: 4-[3-(methylthio)-2H-tetrazol-4-yl]besylate Formula: C8H9N4O3S2- MolecularWeight: 273.31206

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Descriptors Computed from Structure

Canonical SMILES:

CSN1NN=CN1C2=CC=C(C=C2)S(=O)(=O)[O-]

Isomeric SMILES

CSN1NN=CN1C2=CC=C(C=C2)S(=O)(=O)[O-]

InChI

InChI=1S/C8H10N4O3S2/c1-16-12-10-9-6-11(12)7-2-4-8(5-3-7)17(13,14)15/h2-6,10H,1H3,(H,13,14,15)/p-1