methyl 4-methyl-5-sulfanylidene-1H-1,2,4-triazole-3-carboxylate

Systemtic Name: methyl 4-methyl-5-sulfanylidene-1H-1,2,4-triazole-3-carboxylate Openeye Name: methyl 4-methyl-5-thioxo-1H-1,2,4-triazole-3-carboxylate CAS Name: 4-methyl-5-sulfanylidene-1H-1,2,4-triazole-3-carboxylic acid methyl ester IUPAC Name: methyl 4-methyl-5-sulfanylidene-1H-1,2,4-triazole-3-carboxylate Traditional Name: 4-methyl-5-thioxo-1H-1,2,4-triazole-3-carboxylic acid methyl ester Formula: C5H7N3O2S MolecularWeight: 173.19298

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NNC1=S)C(=O)OC

Isomeric SMILES

CN1C(=NNC1=S)C(=O)OC

InChI

InChI=1S/C5H7N3O2S/c1-8-3(4(9)10-2)6-7-5(8)11/h1-2H3,(H,7,11)