2-(4-bromophenyl)-N-[[5-[[2-(4-bromophenyl)quinolin-4-yl]carbonylamino]-1,3,3-trimethyl-cyclohexyl]methyl]quinoline-4-carboxamide

Systemtic Name: 2-(4-bromophenyl)-N-[[5-[[2-(4-bromophenyl)quinolin-4-yl]carbonylamino]-1,3,3-trimethyl-cyclohexyl]methyl]quinoline-4-carboxamide Openeye Name: 2-(4-bromophenyl)-N-[[5-[[2-(4-bromophenyl)quinoline-4-carbonyl]amino]-1,3,3-trimethyl-cyclohexyl]methyl]quinoline-4-carboxamide CAS Name: 2-(4-bromophenyl)-N-[[5-[[[2-(4-bromophenyl)-4-quinolinyl]-oxomethyl]amino]-1,3,3-trimethylcyclohexyl]methyl]-4-quinolinecarboxamide IUPAC Name: 2-(4-bromophenyl)-N-[[5-[[2-(4-bromophenyl)quinoline-4-carbonyl]amino]-1,3,3-trimethylcyclohexyl]methyl]quinoline-4-carboxamide Traditional Name: 2-(4-bromophenyl)-N-[[5-[[2-(4-bromophenyl)quinoline-4-carbonyl]amino]-1,3,3-trimethyl-cyclohexyl]methyl]cinchoninamide Formula: C42H38Br2N4O2 MolecularWeight: 790.58472

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CC(C1)(C)CNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)Br)NC(=O)C5=CC(=NC6=CC=CC=C65)C7=CC=C(C=C7)Br)C

Isomeric SMILES

CC1(CC(CC(C1)(C)CNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)Br)NC(=O)C5=CC(=NC6=CC=CC=C65)C7=CC=C(C=C7)Br)C

InChI

InChI=1S/C42H38Br2N4O2/c1-41(2)22-30(46-40(50)34-21-38(27-14-18-29(44)19-15-27)48-36-11-7-5-9-32(34)36)23-42(3,24-41)25-45-39(49)33-20-37(26-12-16-28(43)17-13-26)47-35-10-6-4-8-31(33)35/h4-21,30H,22-25H2,1-3H3,(H,45,49)(H,46,50)