ethyl 4-(4-methoxyphenyl)-5-methyl-2-(2-phenylsulfanylethanoylamino)thiophene-3-carboxylate

Systemtic Name: ethyl 4-(4-methoxyphenyl)-5-methyl-2-(2-phenylsulfanylethanoylamino)thiophene-3-carboxylate Openeye Name: ethyl 4-(4-methoxyphenyl)-5-methyl-2-[(2-phenylsulfanylacetyl)amino]thiophene-3-carboxylate CAS Name: 4-(4-methoxyphenyl)-5-methyl-2-[[1-oxo-2-(phenylthio)ethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-methoxyphenyl)-5-methyl-2-[(2-phenylsulfanylacetyl)amino]thiophene-3-carboxylate Traditional Name: 4-(4-methoxyphenyl)-5-methyl-2-[[2-(phenylthio)acetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C23H23NO4S2 MolecularWeight: 441.56302

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C2=CC=C(C=C2)OC)C)NC(=O)CSC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C2=CC=C(C=C2)OC)C)NC(=O)CSC3=CC=CC=C3

InChI

InChI=1S/C23H23NO4S2/c1-4-28-23(26)21-20(16-10-12-17(27-3)13-11-16)15(2)30-22(21)24-19(25)14-29-18-8-6-5-7-9-18/h5-13H,4,14H2,1-3H3,(H,24,25)