ethyl 4-(ethoxycarbonylcarbamoyl)-3-methyl-5-[4-(4-methylphenyl)sulfanylbutanoylamino]thiophene-2-carboxylate

Systemtic Name: ethyl 4-(ethoxycarbonylcarbamoyl)-3-methyl-5-[4-(4-methylphenyl)sulfanylbutanoylamino]thiophene-2-carboxylate Openeye Name: ethyl 4-(ethoxycarbonylcarbamoyl)-3-methyl-5-[4-(p-tolylsulfanyl)butanoylamino]thiophene-2-carboxylate CAS Name: 4-[(ethoxycarbonylamino)-oxomethyl]-3-methyl-5-[[4-[(4-methylphenyl)thio]-1-oxobutyl]amino]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(ethoxycarbonylcarbamoyl)-3-methyl-5-[4-(4-methylphenyl)sulfanylbutanoylamino]thiophene-2-carboxylate Traditional Name: 4-(carbethoxycarbamoyl)-3-methyl-5-[4-(p-tolylthio)butanoylamino]thiophene-2-carboxylic acid ethyl ester Formula: C23H28N2O6S2 MolecularWeight: 492.60822

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)NC(=O)CCCSC2=CC=C(C=C2)C)C(=O)NC(=O)OCC)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)NC(=O)CCCSC2=CC=C(C=C2)C)C(=O)NC(=O)OCC)C

InChI

InChI=1S/C23H28N2O6S2/c1-5-30-22(28)19-15(4)18(20(27)25-23(29)31-6-2)21(33-19)24-17(26)8-7-13-32-16-11-9-14(3)10-12-16/h9-12H,5-8,13H2,1-4H3,(H,24,26)(H,25,27,29)