N-[1-(1H-indol-3-yl)-2-phenyl-ethyl]-N'-(4-methoxyquinolin-2-yl)-2-(phenylmethyl)propane-1,3-diamine

Systemtic Name: N-[1-(1H-indol-3-yl)-2-phenyl-ethyl]-N'-(4-methoxyquinolin-2-yl)-2-(phenylmethyl)propane-1,3-diamine Openeye Name: 2-benzyl-N-[1-(1H-indol-3-yl)-2-phenyl-ethyl]-N'-(4-methoxy-2-quinolyl)propane-1,3-diamine CAS Name: N-[1-(1H-indol-3-yl)-2-phenylethyl]-N'-(4-methoxy-2-quinolinyl)-2-(phenylmethyl)propane-1,3-diamine IUPAC Name: 2-benzyl-N-[1-(1H-indol-3-yl)-2-phenylethyl]-N'-(4-methoxyquinolin-2-yl)propane-1,3-diamine Traditional Name: [2-benzyl-3-[[1-(1H-indol-3-yl)-2-phenyl-ethyl]amino]propyl]-(4-methoxy-2-quinolyl)amine Formula: C36H36N4O MolecularWeight: 540.69724

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC2=CC=CC=C21)NCC(CC3=CC=CC=C3)CNC(CC4=CC=CC=C4)C5=CNC6=CC=CC=C65

Isomeric SMILES

COC1=CC(=NC2=CC=CC=C21)NCC(CC3=CC=CC=C3)CNC(CC4=CC=CC=C4)C5=CNC6=CC=CC=C65

InChI

InChI=1S/C36H36N4O/c1-41-35-22-36(40-33-19-11-9-17-30(33)35)39-24-28(20-26-12-4-2-5-13-26)23-37-34(21-27-14-6-3-7-15-27)31-25-38-32-18-10-8-16-29(31)32/h2-19,22,25,28,34,37-38H,20-21,23-24H2,1H3,(H,39,40)