2-[[4-(2-azanyl-2-oxidanylidene-ethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoate

Systemtic Name: 2-[[4-(2-azanyl-2-oxidanylidene-ethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoate Openeye Name: 2-[[4-(2-amino-2-oxo-ethyl)-1,2,4-triazol-3-yl]sulfanyl]acetate CAS Name: 2-[[4-(2-amino-2-oxoethyl)-1,2,4-triazol-3-yl]thio]acetate IUPAC Name: 2-[[4-(2-amino-2-oxoethyl)-1,2,4-triazol-3-yl]sulfanyl]acetate Traditional Name: 2-[[4-(2-amino-2-keto-ethyl)-1,2,4-triazol-3-yl]thio]acetate Formula: C6H7N4O3S- MolecularWeight: 215.20978

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Descriptors Computed from Structure

Canonical SMILES:

C1=NN=C(N1CC(=O)N)SCC(=O)[O-]

Isomeric SMILES

C1=NN=C(N1CC(=O)N)SCC(=O)[O-]

InChI

InChI=1S/C6H8N4O3S/c7-4(11)1-10-3-8-9-6(10)14-2-5(12)13/h3H,1-2H2,(H2,7,11)(H,12,13)/p-1