N-isoquinolin-7-yl-2-(1H-pyrrolo[2,3-b]pyridin-4-ylmethylamino)pyridine-3-carboxamide

Systemtic Name: N-isoquinolin-7-yl-2-(1H-pyrrolo[2,3-b]pyridin-4-ylmethylamino)pyridine-3-carboxamide Openeye Name: N-(7-isoquinolyl)-2-(1H-pyrrolo[2,3-b]pyridin-4-ylmethylamino)pyridine-3-carboxamide CAS Name: N-(7-isoquinolinyl)-2-(1H-pyrrolo[2,3-b]pyridin-4-ylmethylamino)-3-pyridinecarboxamide IUPAC Name: N-isoquinolin-7-yl-2-(1H-pyrrolo[2,3-b]pyridin-4-ylmethylamino)pyridine-3-carboxamide Traditional Name: N-(7-isoquinolyl)-2-(1H-pyrrolo[2,3-b]pyridin-4-ylmethylamino)nicotinamide Formula: C23H18N6O MolecularWeight: 394.42862

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)NCC2=C3C=CNC3=NC=C2)C(=O)NC4=CC5=C(C=C4)C=CN=C5

Isomeric SMILES

C1=CC(=C(N=C1)NCC2=C3C=CNC3=NC=C2)C(=O)NC4=CC5=C(C=C4)C=CN=C5

InChI

InChI=1S/C23H18N6O/c30-23(29-18-4-3-15-5-9-24-13-17(15)12-18)20-2-1-8-25-22(20)28-14-16-6-10-26-21-19(16)7-11-27-21/h1-13H,14H2,(H,25,28)(H,26,27)(H,29,30)