ethyl 2-ethyl-2-(5-sulfanylidene-1,2-dihydro-1,2,3-triazol-4-yl)butanoate

Systemtic Name: ethyl 2-ethyl-2-(5-sulfanylidene-1,2-dihydro-1,2,3-triazol-4-yl)butanoate Openeye Name: ethyl 2-ethyl-2-(5-thioxo-1,2-dihydrotriazol-4-yl)butanoate CAS Name: 2-ethyl-2-(5-sulfanylidene-1,2-dihydrotriazol-4-yl)butanoic acid ethyl ester IUPAC Name: ethyl 2-ethyl-2-(5-sulfanylidene-1,2-dihydrotriazol-4-yl)butanoate Traditional Name: 2-ethyl-2-(5-thioxo-1,2-dihydrotriazol-4-yl)butyric acid ethyl ester Formula: C10H17N3O2S MolecularWeight: 243.32588

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C1=NNNC1=S)C(=O)OCC

Isomeric SMILES

CCC(CC)(C1=NNNC1=S)C(=O)OCC

InChI

InChI=1S/C10H17N3O2S/c1-4-10(5-2,9(14)15-6-3)7-8(16)12-13-11-7/h4-6H2,1-3H3,(H2,11,12,13,16)