ethyl 2-[[4-cyano-2-(2-ethoxy-2-oxidanylidene-ethyl)sulfanyl-1,3-thiazol-5-yl]sulfanyl]ethanoate

Systemtic Name: ethyl 2-[[4-cyano-2-(2-ethoxy-2-oxidanylidene-ethyl)sulfanyl-1,3-thiazol-5-yl]sulfanyl]ethanoate Openeye Name: ethyl 2-[4-cyano-2-(2-ethoxy-2-oxo-ethyl)sulfanyl-thiazol-5-yl]sulfanylacetate CAS Name: 2-[[4-cyano-2-[(2-ethoxy-2-oxoethyl)thio]-5-thiazolyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[[4-cyano-2-(2-ethoxy-2-oxoethyl)sulfanyl-1,3-thiazol-5-yl]sulfanyl]acetate Traditional Name: 2-[[4-cyano-2-[(2-ethoxy-2-keto-ethyl)thio]thiazol-5-yl]thio]acetic acid ethyl ester Formula: C12H14N2O4S3 MolecularWeight: 346.44556

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=C(N=C(S1)SCC(=O)OCC)C#N

Isomeric SMILES

CCOC(=O)CSC1=C(N=C(S1)SCC(=O)OCC)C#N

InChI

InChI=1S/C12H14N2O4S3/c1-3-17-9(15)6-19-11-8(5-13)14-12(21-11)20-7-10(16)18-4-2/h3-4,6-7H2,1-2H3