ethyl 2-[3-(4-chlorophenyl)propanoylamino]-4-(4-methoxyphenyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[3-(4-chlorophenyl)propanoylamino]-4-(4-methoxyphenyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[3-(4-chlorophenyl)propanoylamino]-4-(4-methoxyphenyl)thiophene-3-carboxylate CAS Name: 2-[[3-(4-chlorophenyl)-1-oxopropyl]amino]-4-(4-methoxyphenyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[3-(4-chlorophenyl)propanoylamino]-4-(4-methoxyphenyl)thiophene-3-carboxylate Traditional Name: 2-[3-(4-chlorophenyl)propanoylamino]-4-(4-methoxyphenyl)thiophene-3-carboxylic acid ethyl ester Formula: C23H22ClNO4S MolecularWeight: 443.94308

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)OC)NC(=O)CCC3=CC=C(C=C3)Cl

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)OC)NC(=O)CCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C23H22ClNO4S/c1-3-29-23(27)21-19(16-7-11-18(28-2)12-8-16)14-30-22(21)25-20(26)13-6-15-4-9-17(24)10-5-15/h4-5,7-12,14H,3,6,13H2,1-2H3,(H,25,26)