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

Systemtic Name: 2-sulfanylidene-3-(2H-1,2,3-triazol-4-yl)propanoic acid Openeye Name: 2-thioxo-3-(2H-triazol-4-yl)propanoic acid CAS Name: 2-sulfanylidene-3-(2H-triazol-4-yl)propanoic acid IUPAC Name: 2-sulfanylidene-3-(2H-triazol-4-yl)propanoic acid Traditional Name: 2-thioxo-3-(2H-triazol-4-yl)propionic acid Formula: C5H5N3O2S MolecularWeight: 171.1771

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Descriptors Computed from Structure

Canonical SMILES:

C1=NNN=C1CC(=S)C(=O)O

Isomeric SMILES

C1=NNN=C1CC(=S)C(=O)O

InChI

InChI=1S/C5H5N3O2S/c9-5(10)4(11)1-3-2-6-8-7-3/h2H,1H2,(H,9,10)(H,6,7,8)