methyl 2-[[6-bromanyl-2-(4-propan-2-ylphenyl)quinolin-4-yl]carbonylamino]-4-(4-bromophenyl)thiophene-3-carboxylate

Systemtic Name: methyl 2-[[6-bromanyl-2-(4-propan-2-ylphenyl)quinolin-4-yl]carbonylamino]-4-(4-bromophenyl)thiophene-3-carboxylate Openeye Name: methyl 2-[[6-bromo-2-(4-isopropylphenyl)quinoline-4-carbonyl]amino]-4-(4-bromophenyl)thiophene-3-carboxylate CAS Name: 4-(4-bromophenyl)-2-[[[6-bromo-2-(4-propan-2-ylphenyl)-4-quinolinyl]-oxomethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-(4-bromophenyl)-2-[[6-bromo-2-(4-propan-2-ylphenyl)quinoline-4-carbonyl]amino]thiophene-3-carboxylate Traditional Name: 2-[(6-bromo-2-p-cumenyl-quinoline-4-carbonyl)amino]-4-(4-bromophenyl)thiophene-3-carboxylic acid methyl ester Formula: C31H24Br2N2O3S MolecularWeight: 664.40686

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)NC4=C(C(=CS4)C5=CC=C(C=C5)Br)C(=O)OC

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)NC4=C(C(=CS4)C5=CC=C(C=C5)Br)C(=O)OC

InChI

InChI=1S/C31H24Br2N2O3S/c1-17(2)18-4-6-20(7-5-18)27-15-24(23-14-22(33)12-13-26(23)34-27)29(36)35-30-28(31(37)38-3)25(16-39-30)19-8-10-21(32)11-9-19/h4-17H,1-3H3,(H,35,36)