6-(5-sulfanylidene-2H-1,2,3,4-tetrazol-1-yl)hexanoic acid

Systemtic Name: 6-(5-sulfanylidene-2H-1,2,3,4-tetrazol-1-yl)hexanoic acid Openeye Name: 6-(5-thioxo-2H-tetrazol-1-yl)hexanoic acid CAS Name: 6-(5-sulfanylidene-2H-tetrazol-1-yl)hexanoic acid IUPAC Name: 6-(5-sulfanylidene-2H-tetrazol-1-yl)hexanoic acid Traditional Name: 6-(5-thioxo-2H-tetrazol-1-yl)hexanoic acid Formula: C7H12N4O2S MolecularWeight: 216.26078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H12N4O2S/c12-6(13)4-2-1-3-5-11-7(14)8-9-10-11/h1-5H2,(H,12,13)(H,8,10,14)