ethyl 2-[3-(2-bromanyl-4,5-dimethoxy-phenyl)propanoylamino]-4-(4-chlorophenyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[3-(2-bromanyl-4,5-dimethoxy-phenyl)propanoylamino]-4-(4-chlorophenyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[3-(2-bromo-4,5-dimethoxy-phenyl)propanoylamino]-4-(4-chlorophenyl)thiophene-3-carboxylate CAS Name: 2-[[3-(2-bromo-4,5-dimethoxyphenyl)-1-oxopropyl]amino]-4-(4-chlorophenyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[3-(2-bromo-4,5-dimethoxyphenyl)propanoylamino]-4-(4-chlorophenyl)thiophene-3-carboxylate Traditional Name: 2-[3-(2-bromo-4,5-dimethoxy-phenyl)propanoylamino]-4-(4-chlorophenyl)thiophene-3-carboxylic acid ethyl ester Formula: C24H23BrClNO5S MolecularWeight: 552.86512

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)Cl)NC(=O)CCC3=CC(=C(C=C3Br)OC)OC

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)Cl)NC(=O)CCC3=CC(=C(C=C3Br)OC)OC

InChI

InChI=1S/C24H23BrClNO5S/c1-4-32-24(29)22-17(14-5-8-16(26)9-6-14)13-33-23(22)27-21(28)10-7-15-11-19(30-2)20(31-3)12-18(15)25/h5-6,8-9,11-13H,4,7,10H2,1-3H3,(H,27,28)