5-[3-fluoranyl-4-(1H-pyrrolo[2,3-b]pyridin-4-yloxy)phenyl]-6-methyl-pyrimidine-2,4-diamine

Systemtic Name: 5-[3-fluoranyl-4-(1H-pyrrolo[2,3-b]pyridin-4-yloxy)phenyl]-6-methyl-pyrimidine-2,4-diamine Openeye Name: 5-[3-fluoro-4-(1H-pyrrolo[2,3-b]pyridin-4-yloxy)phenyl]-6-methyl-pyrimidine-2,4-diamine CAS Name: 5-[3-fluoro-4-(1H-pyrrolo[2,3-b]pyridin-4-yloxy)phenyl]-6-methylpyrimidine-2,4-diamine IUPAC Name: 5-[3-fluoro-4-(1H-pyrrolo[2,3-b]pyridin-4-yloxy)phenyl]-6-methylpyrimidine-2,4-diamine Traditional Name: [2-amino-5-[3-fluoro-4-(1H-pyrrolo[2,3-b]pyridin-4-yloxy)phenyl]-6-methyl-pyrimidin-4-yl]amine Formula: C18H15FN6O MolecularWeight: 350.349703

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)N)N)C2=CC(=C(C=C2)OC3=C4C=CNC4=NC=C3)F

Isomeric SMILES

CC1=C(C(=NC(=N1)N)N)C2=CC(=C(C=C2)OC3=C4C=CNC4=NC=C3)F

InChI

InChI=1S/C18H15FN6O/c1-9-15(16(20)25-18(21)24-9)10-2-3-14(12(19)8-10)26-13-5-7-23-17-11(13)4-6-22-17/h2-8H,1H3,(H,22,23)(H4,20,21,24,25)