2-(4-methylpiperazin-1-yl)-5-[8-(2-pyridin-3-ylethynyl)imidazo[4,5-c]quinolin-1-yl]benzenecarbonitrile

Systemtic Name: 2-(4-methylpiperazin-1-yl)-5-[8-(2-pyridin-3-ylethynyl)imidazo[4,5-c]quinolin-1-yl]benzenecarbonitrile Openeye Name: 2-(4-methylpiperazin-1-yl)-5-[8-[2-(3-pyridyl)ethynyl]imidazo[4,5-c]quinolin-1-yl]benzonitrile CAS Name: 2-(4-methyl-1-piperazinyl)-5-[8-[2-(3-pyridinyl)ethynyl]-1-imidazo[4,5-c]quinolinyl]benzonitrile IUPAC Name: 2-(4-methylpiperazin-1-yl)-5-[8-(2-pyridin-3-ylethynyl)imidazo[4,5-c]quinolin-1-yl]benzonitrile Traditional Name: 2-(4-methylpiperazino)-5-[8-[2-(3-pyridyl)ethynyl]imidazo[4,5-c]quinolin-1-yl]benzonitrile Formula: C29H23N7 MolecularWeight: 469.53982

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C=C(C=C2)N3C=NC4=CN=C5C=CC(=CC5=C43)C#CC6=CN=CC=C6)C#N

Isomeric SMILES

CN1CCN(CC1)C2=C(C=C(C=C2)N3C=NC4=CN=C5C=CC(=CC5=C43)C#CC6=CN=CC=C6)C#N

InChI

InChI=1S/C29H23N7/c1-34-11-13-35(14-12-34)28-9-7-24(16-23(28)17-30)36-20-33-27-19-32-26-8-6-21(15-25(26)29(27)36)4-5-22-3-2-10-31-18-22/h2-3,6-10,15-16,18-20H,11-14H2,1H3