2-(3-methylphenyl)-N-[7-[[2-(3-methylphenyl)quinolin-4-yl]carbonylamino]heptyl]quinoline-4-carboxamide

Systemtic Name: 2-(3-methylphenyl)-N-[7-[[2-(3-methylphenyl)quinolin-4-yl]carbonylamino]heptyl]quinoline-4-carboxamide Openeye Name: 2-(m-tolyl)-N-[7-[[2-(m-tolyl)quinoline-4-carbonyl]amino]heptyl]quinoline-4-carboxamide CAS Name: 2-(3-methylphenyl)-N-[7-[[[2-(3-methylphenyl)-4-quinolinyl]-oxomethyl]amino]heptyl]-4-quinolinecarboxamide IUPAC Name: 2-(3-methylphenyl)-N-[7-[[2-(3-methylphenyl)quinoline-4-carbonyl]amino]heptyl]quinoline-4-carboxamide Traditional Name: 2-(m-tolyl)-N-[7-[[2-(m-tolyl)quinoline-4-carbonyl]amino]heptyl]cinchoninamide Formula: C41H40N4O2 MolecularWeight: 620.7819

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCCCCCCCNC(=O)C4=CC(=NC5=CC=CC=C54)C6=CC(=CC=C6)C

Isomeric SMILES

CC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCCCCCCCNC(=O)C4=CC(=NC5=CC=CC=C54)C6=CC(=CC=C6)C

InChI

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