5-(5-sulfanylidene-2H-1,2,3,4-tetrazol-1-yl)pentane-1-sulfonic acid

Systemtic Name: 5-(5-sulfanylidene-2H-1,2,3,4-tetrazol-1-yl)pentane-1-sulfonic acid Openeye Name: 5-(5-thioxo-2H-tetrazol-1-yl)pentane-1-sulfonic acid CAS Name: 5-(5-sulfanylidene-2H-tetrazol-1-yl)-1-pentanesulfonic acid IUPAC Name: 5-(5-sulfanylidene-2H-tetrazol-1-yl)pentane-1-sulfonic acid Traditional Name: 5-(5-thioxo-2H-tetrazol-1-yl)pentane-1-sulfonic acid Formula: C6H12N4O3S2 MolecularWeight: 252.31448

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Descriptors Computed from Structure

Canonical SMILES:

C(CCN1C(=S)N=NN1)CCS(=O)(=O)O

Isomeric SMILES

C(CCN1C(=S)N=NN1)CCS(=O)(=O)O

InChI

InChI=1S/C6H12N4O3S2/c11-15(12,13)5-3-1-2-4-10-6(14)7-8-9-10/h1-5H2,(H,7,9,14)(H,11,12,13)