methyl 4-(4-bromophenyl)-2-[[2-(2,4-dimethoxyphenyl)quinolin-4-yl]carbonylamino]thiophene-3-carboxylate

Systemtic Name: methyl 4-(4-bromophenyl)-2-[[2-(2,4-dimethoxyphenyl)quinolin-4-yl]carbonylamino]thiophene-3-carboxylate Openeye Name: methyl 4-(4-bromophenyl)-2-[[2-(2,4-dimethoxyphenyl)quinoline-4-carbonyl]amino]thiophene-3-carboxylate CAS Name: 4-(4-bromophenyl)-2-[[[2-(2,4-dimethoxyphenyl)-4-quinolinyl]-oxomethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-(4-bromophenyl)-2-[[2-(2,4-dimethoxyphenyl)quinoline-4-carbonyl]amino]thiophene-3-carboxylate Traditional Name: 4-(4-bromophenyl)-2-[[2-(2,4-dimethoxyphenyl)quinoline-4-carbonyl]amino]thiophene-3-carboxylic acid methyl ester Formula: C30H23BrN2O5S MolecularWeight: 603.48302

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=C(C(=CS4)C5=CC=C(C=C5)Br)C(=O)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=C(C(=CS4)C5=CC=C(C=C5)Br)C(=O)OC)OC

InChI

InChI=1S/C30H23BrN2O5S/c1-36-19-12-13-21(26(14-19)37-2)25-15-22(20-6-4-5-7-24(20)32-25)28(34)33-29-27(30(35)38-3)23(16-39-29)17-8-10-18(31)11-9-17/h4-16H,1-3H3,(H,33,34)