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

Systemtic Name: 5-[2-(dimethylamino)-8-(2-pyridin-3-ylethynyl)imidazo[4,5-c]quinolin-1-yl]-2-piperazin-1-yl-benzenecarbonitrile Openeye Name: 5-[2-(dimethylamino)-8-[2-(3-pyridyl)ethynyl]imidazo[4,5-c]quinolin-1-yl]-2-piperazin-1-yl-benzonitrile CAS Name: 5-[2-(dimethylamino)-8-[2-(3-pyridinyl)ethynyl]-1-imidazo[4,5-c]quinolinyl]-2-(1-piperazinyl)benzonitrile IUPAC Name: 5-[2-(dimethylamino)-8-(2-pyridin-3-ylethynyl)imidazo[4,5-c]quinolin-1-yl]-2-piperazin-1-ylbenzonitrile Traditional Name: 5-[2-(dimethylamino)-8-[2-(3-pyridyl)ethynyl]imidazo[4,5-c]quinolin-1-yl]-2-piperazino-benzonitrile Formula: C30H26N8 MolecularWeight: 498.58104

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC2=CN=C3C=CC(=CC3=C2N1C4=CC(=C(C=C4)N5CCNCC5)C#N)C#CC6=CN=CC=C6

Isomeric SMILES

CN(C)C1=NC2=CN=C3C=CC(=CC3=C2N1C4=CC(=C(C=C4)N5CCNCC5)C#N)C#CC6=CN=CC=C6

InChI

InChI=1S/C30H26N8/c1-36(2)30-35-27-20-34-26-9-7-21(5-6-22-4-3-11-33-19-22)16-25(26)29(27)38(30)24-8-10-28(23(17-24)18-31)37-14-12-32-13-15-37/h3-4,7-11,16-17,19-20,32H,12-15H2,1-2H3