ethyl 2-[2-(2-ethoxy-2-oxidanylidene-ethyl)sulfanylpropanoylamino]-5-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(2-ethoxy-2-oxidanylidene-ethyl)sulfanylpropanoylamino]-5-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[2-(2-ethoxy-2-oxo-ethyl)sulfanylpropanoylamino]-5-phenyl-thiophene-3-carboxylate CAS Name: 2-[[2-[(2-ethoxy-2-oxoethyl)thio]-1-oxopropyl]amino]-5-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[2-(2-ethoxy-2-oxoethyl)sulfanylpropanoylamino]-5-phenylthiophene-3-carboxylate Traditional Name: 2-[2-[(2-ethoxy-2-keto-ethyl)thio]propanoylamino]-5-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C20H23NO5S2 MolecularWeight: 421.53032

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC(C)C(=O)NC1=C(C=C(S1)C2=CC=CC=C2)C(=O)OCC

Isomeric SMILES

CCOC(=O)CSC(C)C(=O)NC1=C(C=C(S1)C2=CC=CC=C2)C(=O)OCC

InChI

InChI=1S/C20H23NO5S2/c1-4-25-17(22)12-27-13(3)18(23)21-19-15(20(24)26-5-2)11-16(28-19)14-9-7-6-8-10-14/h6-11,13H,4-5,12H2,1-3H3,(H,21,23)