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

Systemtic Name: 2-[[5-[(2-methylphenyl)carbamoyl]-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoic acid Openeye Name: 2-[[5-(o-tolylcarbamoyl)-1,3,4-thiadiazol-2-yl]sulfanyl]acetic acid CAS Name: 2-[[5-[(2-methylanilino)-oxomethyl]-1,3,4-thiadiazol-2-yl]thio]acetic acid IUPAC Name: 2-[[5-[(2-methylphenyl)carbamoyl]-1,3,4-thiadiazol-2-yl]sulfanyl]acetic acid Traditional Name: 2-[[5-(o-tolylcarbamoyl)-1,3,4-thiadiazol-2-yl]thio]acetic acid Formula: C12H11N3O3S2 MolecularWeight: 309.36404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C2=NN=C(S2)SCC(=O)O

Isomeric SMILES

CC1=CC=CC=C1NC(=O)C2=NN=C(S2)SCC(=O)O

InChI

InChI=1S/C12H11N3O3S2/c1-7-4-2-3-5-8(7)13-10(18)11-14-15-12(20-11)19-6-9(16)17/h2-5H,6H2,1H3,(H,13,18)(H,16,17)