ethyl 4-methyl-5-(methylcarbamoyl)-2-(2-phenylsulfanylpropanoylamino)thiophene-3-carboxylate

Systemtic Name: ethyl 4-methyl-5-(methylcarbamoyl)-2-(2-phenylsulfanylpropanoylamino)thiophene-3-carboxylate Openeye Name: ethyl 4-methyl-5-(methylcarbamoyl)-2-(2-phenylsulfanylpropanoylamino)thiophene-3-carboxylate CAS Name: 4-methyl-5-(methylcarbamoyl)-2-[[1-oxo-2-(phenylthio)propyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-5-(methylcarbamoyl)-2-(2-phenylsulfanylpropanoylamino)thiophene-3-carboxylate Traditional Name: 4-methyl-5-(methylcarbamoyl)-2-[2-(phenylthio)propanoylamino]thiophene-3-carboxylic acid ethyl ester Formula: C19H22N2O4S2 MolecularWeight: 406.51898

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)NC)NC(=O)C(C)SC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)NC)NC(=O)C(C)SC2=CC=CC=C2

InChI

InChI=1S/C19H22N2O4S2/c1-5-25-19(24)14-11(2)15(17(23)20-4)27-18(14)21-16(22)12(3)26-13-9-7-6-8-10-13/h6-10,12H,5H2,1-4H3,(H,20,23)(H,21,22)