ethyl 4-cyano-5-(2-ethoxy-2-oxidanylidene-ethyl)sulfanyl-3-methyl-thiophene-2-carboxylate

Systemtic Name: ethyl 4-cyano-5-(2-ethoxy-2-oxidanylidene-ethyl)sulfanyl-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 4-cyano-5-(2-ethoxy-2-oxo-ethyl)sulfanyl-3-methyl-thiophene-2-carboxylate CAS Name: 4-cyano-5-[(2-ethoxy-2-oxoethyl)thio]-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-cyano-5-(2-ethoxy-2-oxoethyl)sulfanyl-3-methylthiophene-2-carboxylate Traditional Name: 4-cyano-5-[(2-ethoxy-2-keto-ethyl)thio]-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C13H15NO4S2 MolecularWeight: 313.3925

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15NO4S2/c1-4-17-10(15)7-19-13-9(6-14)8(3)11(20-13)12(16)18-5-2/h4-5,7H2,1-3H3