2-[2-azanyl-3-(5-isoquinolin-6-ylpyridin-3-yl)oxy-propyl]benzenecarbonitrile

Systemtic Name: 2-[2-azanyl-3-(5-isoquinolin-6-ylpyridin-3-yl)oxy-propyl]benzenecarbonitrile Openeye Name: 2-[2-amino-3-[[5-(6-isoquinolyl)-3-pyridyl]oxy]propyl]benzonitrile CAS Name: 2-[2-amino-3-[[5-(6-isoquinolinyl)-3-pyridinyl]oxy]propyl]benzonitrile IUPAC Name: 2-[2-amino-3-(5-isoquinolin-6-ylpyridin-3-yl)oxypropyl]benzonitrile Traditional Name: 2-[2-amino-3-[[5-(6-isoquinolyl)-3-pyridyl]oxy]propyl]benzonitrile Formula: C24H20N4O MolecularWeight: 380.4418

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CC(COC2=CN=CC(=C2)C3=CC4=C(C=C3)C=NC=C4)N)C#N

Isomeric SMILES

C1=CC=C(C(=C1)CC(COC2=CN=CC(=C2)C3=CC4=C(C=C3)C=NC=C4)N)C#N

InChI

InChI=1S/C24H20N4O/c25-12-20-4-2-1-3-17(20)10-23(26)16-29-24-11-22(14-28-15-24)18-5-6-21-13-27-8-7-19(21)9-18/h1-9,11,13-15,23H,10,16,26H2