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

Systemtic Name: 4-methyl-2-[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)sulfanyl]benzoic acid Openeye Name: 4-methyl-2-[(2-thioxo-3H-1,3,4-thiadiazol-5-yl)sulfanyl]benzoic acid CAS Name: 4-methyl-2-[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)thio]benzoic acid IUPAC Name: 4-methyl-2-[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)sulfanyl]benzoic acid Traditional Name: 4-methyl-2-[(2-thioxo-3H-1,3,4-thiadiazol-5-yl)thio]benzoic acid Formula: C10H8N2O2S3 MolecularWeight: 284.37772

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)O)SC2=NNC(=S)S2

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)O)SC2=NNC(=S)S2

InChI

InChI=1S/C10H8N2O2S3/c1-5-2-3-6(8(13)14)7(4-5)16-10-12-11-9(15)17-10/h2-4H,1H3,(H,11,15)(H,13,14)