2-(4-methyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)ethanoic acid

Systemtic Name: 2-(4-methyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)ethanoic acid Openeye Name: 2-(4-methyl-5-thioxo-1H-1,2,4-triazol-3-yl)acetic acid CAS Name: 2-(4-methyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)acetic acid IUPAC Name: 2-(4-methyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)acetic acid Traditional Name: 2-(4-methyl-5-thioxo-1H-1,2,4-triazol-3-yl)acetic acid Formula: C5H7N3O2S MolecularWeight: 173.19298

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NNC1=S)CC(=O)O

Isomeric SMILES

CN1C(=NNC1=S)CC(=O)O

InChI

InChI=1S/C5H7N3O2S/c1-8-3(2-4(9)10)6-7-5(8)11/h2H2,1H3,(H,7,11)(H,9,10)