2-[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)sulfanyl]hexanoic acid

Systemtic Name: 2-[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)sulfanyl]hexanoic acid Openeye Name: 2-[(2-thioxo-3H-1,3,4-thiadiazol-5-yl)sulfanyl]hexanoic acid CAS Name: 2-[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)thio]hexanoic acid IUPAC Name: 2-[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)sulfanyl]hexanoic acid Traditional Name: 2-[(2-thioxo-3H-1,3,4-thiadiazol-5-yl)thio]hexanoic acid Formula: C8H12N2O2S3 MolecularWeight: 264.38808

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)O)SC1=NNC(=S)S1

Isomeric SMILES

CCCCC(C(=O)O)SC1=NNC(=S)S1

InChI

InChI=1S/C8H12N2O2S3/c1-2-3-4-5(6(11)12)14-8-10-9-7(13)15-8/h5H,2-4H2,1H3,(H,9,13)(H,11,12)