ethyl 2-[2-[2,4-bis(bromanyl)phenoxy]ethanoylamino]-4-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-[2,4-bis(bromanyl)phenoxy]ethanoylamino]-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(2,4-dibromophenoxy)acetyl]amino]-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[2-(2,4-dibromophenoxy)-1-oxoethyl]amino]-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(2,4-dibromophenoxy)acetyl]amino]-4-phenylthiophene-3-carboxylate Traditional Name: 2-[[2-(2,4-dibromophenoxy)acetyl]amino]-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C21H17Br2NO4S MolecularWeight: 539.23698

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H17Br2NO4S/c1-2-27-21(26)19-15(13-6-4-3-5-7-13)12-29-20(19)24-18(25)11-28-17-9-8-14(22)10-16(17)23/h3-10,12H,2,11H2,1H3,(H,24,25)