ethyl 2-[2-(2-bromanyl-4-propyl-phenoxy)ethanoylamino]-4-(4-bromophenyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(2-bromanyl-4-propyl-phenoxy)ethanoylamino]-4-(4-bromophenyl)thiophene-3-carboxylate Openeye Name: ethyl 4-(4-bromophenyl)-2-[[2-(2-bromo-4-propyl-phenoxy)acetyl]amino]thiophene-3-carboxylate CAS Name: 4-(4-bromophenyl)-2-[[2-(2-bromo-4-propylphenoxy)-1-oxoethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-bromophenyl)-2-[[2-(2-bromo-4-propylphenoxy)acetyl]amino]thiophene-3-carboxylate Traditional Name: 4-(4-bromophenyl)-2-[[2-(2-bromo-4-propyl-phenoxy)acetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C24H23Br2NO4S MolecularWeight: 581.31672

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(C=C1)OCC(=O)NC2=C(C(=CS2)C3=CC=C(C=C3)Br)C(=O)OCC)Br

Isomeric SMILES

CCCC1=CC(=C(C=C1)OCC(=O)NC2=C(C(=CS2)C3=CC=C(C=C3)Br)C(=O)OCC)Br

InChI

InChI=1S/C24H23Br2NO4S/c1-3-5-15-6-11-20(19(26)12-15)31-13-21(28)27-23-22(24(29)30-4-2)18(14-32-23)16-7-9-17(25)10-8-16/h6-12,14H,3-5,13H2,1-2H3,(H,27,28)