ethyl 2-[2-[2,4-bis(bromanyl)phenoxy]ethanoylamino]-5-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-[2,4-bis(bromanyl)phenoxy]ethanoylamino]-5-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(2,4-dibromophenoxy)acetyl]amino]-5-phenyl-thiophene-3-carboxylate CAS Name: 2-[[2-(2,4-dibromophenoxy)-1-oxoethyl]amino]-5-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(2,4-dibromophenoxy)acetyl]amino]-5-phenylthiophene-3-carboxylate Traditional Name: 2-[[2-(2,4-dibromophenoxy)acetyl]amino]-5-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(=C1)C2=CC=CC=C2)NC(=O)COC3=C(C=C(C=C3)Br)Br

Isomeric SMILES

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

InChI

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