3-(5-sulfanylidene-1,2-dihydro-1,2,4-triazol-3-yl)propanoic acid

Systemtic Name: 3-(5-sulfanylidene-1,2-dihydro-1,2,4-triazol-3-yl)propanoic acid Openeye Name: 3-(5-thioxo-1,2-dihydro-1,2,4-triazol-3-yl)propanoic acid CAS Name: 3-(5-sulfanylidene-1,2-dihydro-1,2,4-triazol-3-yl)propanoic acid IUPAC Name: 3-(5-sulfanylidene-1,2-dihydro-1,2,4-triazol-3-yl)propanoic acid Traditional Name: 3-(5-thioxo-1,2-dihydro-1,2,4-triazol-3-yl)propionic acid Formula: C5H7N3O2S MolecularWeight: 173.19298

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Descriptors Computed from Structure

Canonical SMILES:

C(CC(=O)O)C1=NC(=S)NN1

Isomeric SMILES

C(CC(=O)O)C1=NC(=S)NN1

InChI

InChI=1S/C5H7N3O2S/c9-4(10)2-1-3-6-5(11)8-7-3/h1-2H2,(H,9,10)(H2,6,7,8,11)