N4-[2-fluoranyl-4-(1H-pyrrolo[2,3-b]pyridin-4-yloxy)phenyl]-6-pyridin-4-yl-pyrimidine-2,4-diamine

Systemtic Name: N4-[2-fluoranyl-4-(1H-pyrrolo[2,3-b]pyridin-4-yloxy)phenyl]-6-pyridin-4-yl-pyrimidine-2,4-diamine Openeye Name: N4-[2-fluoro-4-(1H-pyrrolo[2,3-b]pyridin-4-yloxy)phenyl]-6-(4-pyridyl)pyrimidine-2,4-diamine CAS Name: N4-[2-fluoro-4-(1H-pyrrolo[2,3-b]pyridin-4-yloxy)phenyl]-6-pyridin-4-ylpyrimidine-2,4-diamine IUPAC Name: 4-N-[2-fluoro-4-(1H-pyrrolo[2,3-b]pyridin-4-yloxy)phenyl]-6-pyridin-4-ylpyrimidine-2,4-diamine Traditional Name: [2-amino-6-(4-pyridyl)pyrimidin-4-yl]-[2-fluoro-4-(1H-pyrrolo[2,3-b]pyridin-4-yloxy)phenyl]amine Formula: C22H16FN7O MolecularWeight: 413.407143

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1OC2=C3C=CNC3=NC=C2)F)NC4=NC(=NC(=C4)C5=CC=NC=C5)N

Isomeric SMILES

C1=CC(=C(C=C1OC2=C3C=CNC3=NC=C2)F)NC4=NC(=NC(=C4)C5=CC=NC=C5)N

InChI

InChI=1S/C22H16FN7O/c23-16-11-14(31-19-6-10-27-21-15(19)5-9-26-21)1-2-17(16)28-20-12-18(29-22(24)30-20)13-3-7-25-8-4-13/h1-12H,(H,26,27)(H3,24,28,29,30)