N-[(5-fluoranyl-2-methoxy-pyridin-3-yl)methyl]-5-(7H-pyrrolo[2,3-d]pyrimidin-5-ylmethyl)pyrimidin-2-amine

Systemtic Name: N-[(5-fluoranyl-2-methoxy-pyridin-3-yl)methyl]-5-(7H-pyrrolo[2,3-d]pyrimidin-5-ylmethyl)pyrimidin-2-amine Openeye Name: N-[(5-fluoro-2-methoxy-3-pyridyl)methyl]-5-(7H-pyrrolo[2,3-d]pyrimidin-5-ylmethyl)pyrimidin-2-amine CAS Name: N-[(5-fluoro-2-methoxy-3-pyridinyl)methyl]-5-(7H-pyrrolo[2,3-d]pyrimidin-5-ylmethyl)-2-pyrimidinamine IUPAC Name: N-[(5-fluoro-2-methoxypyridin-3-yl)methyl]-5-(7H-pyrrolo[2,3-d]pyrimidin-5-ylmethyl)pyrimidin-2-amine Traditional Name: (5-fluoro-2-methoxy-3-pyridyl)methyl-[5-(7H-pyrrolo[2,3-d]pyrimidin-5-ylmethyl)pyrimidin-2-yl]amine Formula: C18H16FN7O MolecularWeight: 365.364343

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=C(C=C1CNC2=NC=C(C=N2)CC3=CNC4=NC=NC=C34)F

Isomeric SMILES

COC1=NC=C(C=C1CNC2=NC=C(C=N2)CC3=CNC4=NC=NC=C34)F

InChI

InChI=1S/C18H16FN7O/c1-27-17-13(3-14(19)8-22-17)7-25-18-23-4-11(5-24-18)2-12-6-21-16-15(12)9-20-10-26-16/h3-6,8-10H,2,7H2,1H3,(H,20,21,26)(H,23,24,25)