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

Systemtic Name: ethyl 2-methyl-3-sulfanylidene-1H-1,2,4-triazole-5-carboxylate Openeye Name: ethyl 2-methyl-3-thioxo-1H-1,2,4-triazole-5-carboxylate CAS Name: 2-methyl-3-sulfanylidene-1H-1,2,4-triazole-5-carboxylic acid ethyl ester IUPAC Name: ethyl 2-methyl-3-sulfanylidene-1H-1,2,4-triazole-5-carboxylate Traditional Name: 2-methyl-3-thioxo-1H-1,2,4-triazole-5-carboxylic acid ethyl ester Formula: C6H9N3O2S MolecularWeight: 187.21956

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC(=S)N(N1)C

Isomeric SMILES

CCOC(=O)C1=NC(=S)N(N1)C

InChI

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