N-isoquinolin-3-yl-2-(pyridin-4-ylmethylamino)pyridine-3-carboxamide

Systemtic Name: N-isoquinolin-3-yl-2-(pyridin-4-ylmethylamino)pyridine-3-carboxamide Openeye Name: N-(3-isoquinolyl)-2-(4-pyridylmethylamino)pyridine-3-carboxamide CAS Name: N-(3-isoquinolinyl)-2-(pyridin-4-ylmethylamino)-3-pyridinecarboxamide IUPAC Name: N-isoquinolin-3-yl-2-(pyridin-4-ylmethylamino)pyridine-3-carboxamide Traditional Name: N-(3-isoquinolyl)-2-(4-pyridylmethylamino)nicotinamide Formula: C21H17N5O MolecularWeight: 355.39258

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=NC(=CC2=C1)NC(=O)C3=C(N=CC=C3)NCC4=CC=NC=C4

Isomeric SMILES

C1=CC=C2C=NC(=CC2=C1)NC(=O)C3=C(N=CC=C3)NCC4=CC=NC=C4

InChI

InChI=1S/C21H17N5O/c27-21(26-19-12-16-4-1-2-5-17(16)14-24-19)18-6-3-9-23-20(18)25-13-15-7-10-22-11-8-15/h1-12,14H,13H2,(H,23,25)(H,24,26,27)