7-[2-(pyridin-3-ylmethylamino)pyrimidin-4-yl]isoquinolin-1-amine

Systemtic Name: 7-[2-(pyridin-3-ylmethylamino)pyrimidin-4-yl]isoquinolin-1-amine Openeye Name: 7-[2-(3-pyridylmethylamino)pyrimidin-4-yl]isoquinolin-1-amine CAS Name: 7-[2-(3-pyridinylmethylamino)-4-pyrimidinyl]-1-isoquinolinamine IUPAC Name: 7-[2-(pyridin-3-ylmethylamino)pyrimidin-4-yl]isoquinolin-1-amine Traditional Name: [4-(1-amino-7-isoquinolyl)pyrimidin-2-yl]-(3-pyridylmethyl)amine Formula: C19H16N6 MolecularWeight: 328.37054

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CNC2=NC=CC(=N2)C3=CC4=C(C=C3)C=CN=C4N

Isomeric SMILES

C1=CC(=CN=C1)CNC2=NC=CC(=N2)C3=CC4=C(C=C3)C=CN=C4N

InChI

InChI=1S/C19H16N6/c20-18-16-10-15(4-3-14(16)5-8-22-18)17-6-9-23-19(25-17)24-12-13-2-1-7-21-11-13/h1-11H,12H2,(H2,20,22)(H,23,24,25)