2-(1-azanylisoquinolin-7-yl)oxy-N-[4-(3-cyanophenyl)phenyl]pentanamide

Systemtic Name: 2-(1-azanylisoquinolin-7-yl)oxy-N-[4-(3-cyanophenyl)phenyl]pentanamide Openeye Name: 2-[(1-amino-7-isoquinolyl)oxy]-N-[4-(3-cyanophenyl)phenyl]pentanamide CAS Name: 2-[(1-amino-7-isoquinolinyl)oxy]-N-[4-(3-cyanophenyl)phenyl]pentanamide IUPAC Name: 2-(1-aminoisoquinolin-7-yl)oxy-N-[4-(3-cyanophenyl)phenyl]pentanamide Traditional Name: 2-[(1-amino-7-isoquinolyl)oxy]-N-[4-(3-cyanophenyl)phenyl]valeramide Formula: C27H24N4O2 MolecularWeight: 436.50506

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)NC1=CC=C(C=C1)C2=CC=CC(=C2)C#N)OC3=CC4=C(C=C3)C=CN=C4N

Isomeric SMILES

CCCC(C(=O)NC1=CC=C(C=C1)C2=CC=CC(=C2)C#N)OC3=CC4=C(C=C3)C=CN=C4N

InChI

InChI=1S/C27H24N4O2/c1-2-4-25(33-23-12-9-20-13-14-30-26(29)24(20)16-23)27(32)31-22-10-7-19(8-11-22)21-6-3-5-18(15-21)17-28/h3,5-16,25H,2,4H2,1H3,(H2,29,30)(H,31,32)