2-(4-ethylphenyl)-N-[3-[4-[3-[[2-(4-ethylphenyl)quinolin-4-yl]carbonylamino]propyl]piperazin-1-yl]propyl]quinoline-4-carboxamide

Systemtic Name: 2-(4-ethylphenyl)-N-[3-[4-[3-[[2-(4-ethylphenyl)quinolin-4-yl]carbonylamino]propyl]piperazin-1-yl]propyl]quinoline-4-carboxamide Openeye Name: 2-(4-ethylphenyl)-N-[3-[4-[3-[[2-(4-ethylphenyl)quinoline-4-carbonyl]amino]propyl]piperazin-1-yl]propyl]quinoline-4-carboxamide CAS Name: 2-(4-ethylphenyl)-N-[3-[4-[3-[[[2-(4-ethylphenyl)-4-quinolinyl]-oxomethyl]amino]propyl]-1-piperazinyl]propyl]-4-quinolinecarboxamide IUPAC Name: 2-(4-ethylphenyl)-N-[3-[4-[3-[[2-(4-ethylphenyl)quinoline-4-carbonyl]amino]propyl]piperazin-1-yl]propyl]quinoline-4-carboxamide Traditional Name: 2-(4-ethylphenyl)-N-[3-[4-[3-[[2-(4-ethylphenyl)quinoline-4-carbonyl]amino]propyl]piperazino]propyl]cinchoninamide Formula: C46H50N6O2 MolecularWeight: 718.9282

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCCCN4CCN(CC4)CCCNC(=O)C5=CC(=NC6=CC=CC=C65)C7=CC=C(C=C7)CC

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCCCN4CCN(CC4)CCCNC(=O)C5=CC(=NC6=CC=CC=C65)C7=CC=C(C=C7)CC

InChI

InChI=1S/C46H50N6O2/c1-3-33-15-19-35(20-16-33)43-31-39(37-11-5-7-13-41(37)49-43)45(53)47-23-9-25-51-27-29-52(30-28-51)26-10-24-48-46(54)40-32-44(36-21-17-34(4-2)18-22-36)50-42-14-8-6-12-38(40)42/h5-8,11-22,31-32H,3-4,9-10,23-30H2,1-2H3,(H,47,53)(H,48,54)