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

Systemtic Name: methyl 2-(3-methyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)ethanoate Openeye Name: methyl 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)acetic acid methyl ester IUPAC Name: methyl 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)acetic acid methyl ester Formula: C6H9N3O2S MolecularWeight: 187.21956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NNC(=S)N1CC(=O)OC

Isomeric SMILES

CC1=NNC(=S)N1CC(=O)OC

InChI

InChI=1S/C6H9N3O2S/c1-4-7-8-6(12)9(4)3-5(10)11-2/h3H2,1-2H3,(H,8,12)