ethyl 4-(4-bromophenyl)-2-[2-(4-chloranyl-2-methyl-phenoxy)propanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-(4-bromophenyl)-2-[2-(4-chloranyl-2-methyl-phenoxy)propanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-(4-bromophenyl)-2-[2-(4-chloro-2-methyl-phenoxy)propanoylamino]thiophene-3-carboxylate CAS Name: 4-(4-bromophenyl)-2-[[2-(4-chloro-2-methylphenoxy)-1-oxopropyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-bromophenyl)-2-[2-(4-chloro-2-methylphenoxy)propanoylamino]thiophene-3-carboxylate Traditional Name: 4-(4-bromophenyl)-2-[2-(4-chloro-2-methyl-phenoxy)propanoylamino]thiophene-3-carboxylic acid ethyl ester Formula: C23H21BrClNO4S MolecularWeight: 522.83914

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)Br)NC(=O)C(C)OC3=C(C=C(C=C3)Cl)C

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)Br)NC(=O)C(C)OC3=C(C=C(C=C3)Cl)C

InChI

InChI=1S/C23H21BrClNO4S/c1-4-29-23(28)20-18(15-5-7-16(24)8-6-15)12-31-22(20)26-21(27)14(3)30-19-10-9-17(25)11-13(19)2/h5-12,14H,4H2,1-3H3,(H,26,27)