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

Systemtic Name: 2-(3-methyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)ethanoate Openeye Name: 2-(3-methyl-5-thioxo-1H-1,2,4-triazol-4-yl)acetate CAS Name: 2-(3-methyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)acetate IUPAC Name: 2-(3-methyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)acetate Traditional Name: 2-(3-methyl-5-thioxo-1H-1,2,4-triazol-4-yl)acetate Formula: C5H6N3O2S- MolecularWeight: 172.18504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NNC(=S)N1CC(=O)[O-]

Isomeric SMILES

CC1=NNC(=S)N1CC(=O)[O-]

InChI

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