cyanomethyl 2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoate

Systemtic Name: cyanomethyl 2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoate Openeye Name: cyanomethyl 2-[[4-ethyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]acetate CAS Name: 2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]acetic acid cyanomethyl ester IUPAC Name: cyanomethyl 2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetate Traditional Name: 2-[[4-ethyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]acetic acid cyanomethyl ester Formula: C12H12N4O2S2 MolecularWeight: 308.37928

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)OCC#N)C2=CC=CS2

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)OCC#N)C2=CC=CS2

InChI

InChI=1S/C12H12N4O2S2/c1-2-16-11(9-4-3-7-19-9)14-15-12(16)20-8-10(17)18-6-5-13/h3-4,7H,2,6,8H2,1H3