2-(3-bromophenyl)-N-[4-[[2-(3-bromophenyl)quinolin-4-yl]carbonylamino]butyl]quinoline-4-carboxamide

Systemtic Name: 2-(3-bromophenyl)-N-[4-[[2-(3-bromophenyl)quinolin-4-yl]carbonylamino]butyl]quinoline-4-carboxamide Openeye Name: 2-(3-bromophenyl)-N-[4-[[2-(3-bromophenyl)quinoline-4-carbonyl]amino]butyl]quinoline-4-carboxamide CAS Name: 2-(3-bromophenyl)-N-[4-[[[2-(3-bromophenyl)-4-quinolinyl]-oxomethyl]amino]butyl]-4-quinolinecarboxamide IUPAC Name: 2-(3-bromophenyl)-N-[4-[[2-(3-bromophenyl)quinoline-4-carbonyl]amino]butyl]quinoline-4-carboxamide Traditional Name: 2-(3-bromophenyl)-N-[4-[[2-(3-bromophenyl)quinoline-4-carbonyl]amino]butyl]cinchoninamide Formula: C36H28Br2N4O2 MolecularWeight: 708.44112

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC(=CC=C3)Br)C(=O)NCCCCNC(=O)C4=CC(=NC5=CC=CC=C54)C6=CC(=CC=C6)Br

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC(=CC=C3)Br)C(=O)NCCCCNC(=O)C4=CC(=NC5=CC=CC=C54)C6=CC(=CC=C6)Br

InChI

InChI=1S/C36H28Br2N4O2/c37-25-11-7-9-23(19-25)33-21-29(27-13-1-3-15-31(27)41-33)35(43)39-17-5-6-18-40-36(44)30-22-34(24-10-8-12-26(38)20-24)42-32-16-4-2-14-28(30)32/h1-4,7-16,19-22H,5-6,17-18H2,(H,39,43)(H,40,44)