ethyl 4-methyl-3-sulfanylidene-1,2,4-triazolidine-1-carboxylate

Systemtic Name: ethyl 4-methyl-3-sulfanylidene-1,2,4-triazolidine-1-carboxylate Openeye Name: ethyl 4-methyl-3-thioxo-1,2,4-triazolidine-1-carboxylate CAS Name: 4-methyl-3-sulfanylidene-1,2,4-triazolidine-1-carboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-3-sulfanylidene-1,2,4-triazolidine-1-carboxylate Traditional Name: 4-methyl-3-thioxo-1,2,4-triazolidine-1-carboxylic acid ethyl ester Formula: C6H11N3O2S MolecularWeight: 189.23544

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CN(C(=S)N1)C

Isomeric SMILES

CCOC(=O)N1CN(C(=S)N1)C

InChI

InChI=1S/C6H11N3O2S/c1-3-11-6(10)9-4-8(2)5(12)7-9/h3-4H2,1-2H3,(H,7,12)