ethyl 3-methyl-4-(methylcarbamoyl)-5-[2-(4-methylphenyl)sulfanylethanoylamino]thiophene-2-carboxylate

Systemtic Name: ethyl 3-methyl-4-(methylcarbamoyl)-5-[2-(4-methylphenyl)sulfanylethanoylamino]thiophene-2-carboxylate Openeye Name: ethyl 3-methyl-4-(methylcarbamoyl)-5-[[2-(p-tolylsulfanyl)acetyl]amino]thiophene-2-carboxylate CAS Name: 3-methyl-4-(methylcarbamoyl)-5-[[2-[(4-methylphenyl)thio]-1-oxoethyl]amino]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-methyl-4-(methylcarbamoyl)-5-[[2-(4-methylphenyl)sulfanylacetyl]amino]thiophene-2-carboxylate Traditional Name: 3-methyl-4-(methylcarbamoyl)-5-[[2-(p-tolylthio)acetyl]amino]thiophene-2-carboxylic acid ethyl ester Formula: C19H22N2O4S2 MolecularWeight: 406.51898

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)NC(=O)CSC2=CC=C(C=C2)C)C(=O)NC)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)NC(=O)CSC2=CC=C(C=C2)C)C(=O)NC)C

InChI

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