2-[(4-azanyl-1,2,4-triazol-3-yl)sulfanyl]ethanoic acid

Systemtic Name: 2-[(4-azanyl-1,2,4-triazol-3-yl)sulfanyl]ethanoic acid Openeye Name: 2-[(4-amino-1,2,4-triazol-3-yl)sulfanyl]acetic acid CAS Name: 2-[(4-amino-1,2,4-triazol-3-yl)thio]acetic acid IUPAC Name: 2-[(4-amino-1,2,4-triazol-3-yl)sulfanyl]acetic acid Traditional Name: 2-[(4-amino-1,2,4-triazol-3-yl)thio]acetic acid Formula: C4H6N4O2S MolecularWeight: 174.18104

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Descriptors Computed from Structure

Canonical SMILES:

C1=NN=C(N1N)SCC(=O)O

Isomeric SMILES

C1=NN=C(N1N)SCC(=O)O

InChI

InChI=1S/C4H6N4O2S/c5-8-2-6-7-4(8)11-1-3(9)10/h2H,1,5H2,(H,9,10)