2-(2-methylphenyl)-N-[7-[[2-(2-methylphenyl)quinolin-4-yl]carbonylamino]heptyl]quinoline-4-carboxamide

Systemtic Name: 2-(2-methylphenyl)-N-[7-[[2-(2-methylphenyl)quinolin-4-yl]carbonylamino]heptyl]quinoline-4-carboxamide Openeye Name: 2-(o-tolyl)-N-[7-[[2-(o-tolyl)quinoline-4-carbonyl]amino]heptyl]quinoline-4-carboxamide CAS Name: 2-(2-methylphenyl)-N-[7-[[[2-(2-methylphenyl)-4-quinolinyl]-oxomethyl]amino]heptyl]-4-quinolinecarboxamide IUPAC Name: 2-(2-methylphenyl)-N-[7-[[2-(2-methylphenyl)quinoline-4-carbonyl]amino]heptyl]quinoline-4-carboxamide Traditional Name: 2-(o-tolyl)-N-[7-[[2-(o-tolyl)quinoline-4-carbonyl]amino]heptyl]cinchoninamide Formula: C41H40N4O2 MolecularWeight: 620.7819

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NC3=CC=CC=C3C(=C2)C(=O)NCCCCCCCNC(=O)C4=CC(=NC5=CC=CC=C54)C6=CC=CC=C6C

Isomeric SMILES

CC1=CC=CC=C1C2=NC3=CC=CC=C3C(=C2)C(=O)NCCCCCCCNC(=O)C4=CC(=NC5=CC=CC=C54)C6=CC=CC=C6C

InChI

InChI=1S/C41H40N4O2/c1-28-16-6-8-18-30(28)38-26-34(32-20-10-12-22-36(32)44-38)40(46)42-24-14-4-3-5-15-25-43-41(47)35-27-39(31-19-9-7-17-29(31)2)45-37-23-13-11-21-33(35)37/h6-13,16-23,26-27H,3-5,14-15,24-25H2,1-2H3,(H,42,46)(H,43,47)