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

Systemtic Name: ethyl 4-(4-bromophenyl)-2-[3-(4-methoxyphenyl)propanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-(4-bromophenyl)-2-[3-(4-methoxyphenyl)propanoylamino]thiophene-3-carboxylate CAS Name: 4-(4-bromophenyl)-2-[[3-(4-methoxyphenyl)-1-oxopropyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-bromophenyl)-2-[3-(4-methoxyphenyl)propanoylamino]thiophene-3-carboxylate Traditional Name: 4-(4-bromophenyl)-2-[3-(4-methoxyphenyl)propanoylamino]thiophene-3-carboxylic acid ethyl ester Formula: C23H22BrNO4S MolecularWeight: 488.39408

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H22BrNO4S/c1-3-29-23(27)21-19(16-7-9-17(24)10-8-16)14-30-22(21)25-20(26)13-6-15-4-11-18(28-2)12-5-15/h4-5,7-12,14H,3,6,13H2,1-2H3,(H,25,26)