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

Systemtic Name: 2-[[4-(2-methylphenyl)-5-sulfanylidene-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoic acid Openeye Name: 2-[[4-(o-tolyl)-5-thioxo-1,3,4-thiadiazol-2-yl]sulfanyl]acetic acid CAS Name: 2-[[4-(2-methylphenyl)-5-sulfanylidene-1,3,4-thiadiazol-2-yl]thio]acetic acid IUPAC Name: 2-[[4-(2-methylphenyl)-5-sulfanylidene-1,3,4-thiadiazol-2-yl]sulfanyl]acetic acid Traditional Name: 2-[[4-(o-tolyl)-5-thioxo-1,3,4-thiadiazol-2-yl]thio]acetic acid Formula: C11H10N2O2S3 MolecularWeight: 298.4043

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=S)SC(=N2)SCC(=O)O

Isomeric SMILES

CC1=CC=CC=C1N2C(=S)SC(=N2)SCC(=O)O

InChI

InChI=1S/C11H10N2O2S3/c1-7-4-2-3-5-8(7)13-11(16)18-10(12-13)17-6-9(14)15/h2-5H,6H2,1H3,(H,14,15)