ethyl 2-[2-(3-bromanylphenoxy)ethanoylamino]-4-(4-chlorophenyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(3-bromanylphenoxy)ethanoylamino]-4-(4-chlorophenyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(3-bromophenoxy)acetyl]amino]-4-(4-chlorophenyl)thiophene-3-carboxylate CAS Name: 2-[[2-(3-bromophenoxy)-1-oxoethyl]amino]-4-(4-chlorophenyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(3-bromophenoxy)acetyl]amino]-4-(4-chlorophenyl)thiophene-3-carboxylate Traditional Name: 2-[[2-(3-bromophenoxy)acetyl]amino]-4-(4-chlorophenyl)thiophene-3-carboxylic acid ethyl ester Formula: C21H17BrClNO4S MolecularWeight: 494.78598

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)Cl)NC(=O)COC3=CC(=CC=C3)Br

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)Cl)NC(=O)COC3=CC(=CC=C3)Br

InChI

InChI=1S/C21H17BrClNO4S/c1-2-27-21(26)19-17(13-6-8-15(23)9-7-13)12-29-20(19)24-18(25)11-28-16-5-3-4-14(22)10-16/h3-10,12H,2,11H2,1H3,(H,24,25)