5-[9-[1-[(6-fluoranylpyridin-3-yl)methyl]piperidin-4-yl]-6-morpholin-4-yl-purin-2-yl]pyridin-3-ol

Systemtic Name: 5-[9-[1-[(6-fluoranylpyridin-3-yl)methyl]piperidin-4-yl]-6-morpholin-4-yl-purin-2-yl]pyridin-3-ol Openeye Name: 5-[9-[1-[(6-fluoro-3-pyridyl)methyl]-4-piperidyl]-6-morpholino-purin-2-yl]pyridin-3-ol CAS Name: 5-[9-[1-[(6-fluoro-3-pyridinyl)methyl]-4-piperidinyl]-6-(4-morpholinyl)-2-purinyl]-3-pyridinol IUPAC Name: 5-[9-[1-[(6-fluoropyridin-3-yl)methyl]piperidin-4-yl]-6-morpholin-4-ylpurin-2-yl]pyridin-3-ol Traditional Name: 5-[9-[1-[(6-fluoro-3-pyridyl)methyl]-4-piperidyl]-6-morpholino-purin-2-yl]pyridin-3-ol Formula: C25H27FN8O2 MolecularWeight: 490.532683

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C=NC3=C2N=C(N=C3N4CCOCC4)C5=CC(=CN=C5)O)CC6=CN=C(C=C6)F

Isomeric SMILES

C1CN(CCC1N2C=NC3=C2N=C(N=C3N4CCOCC4)C5=CC(=CN=C5)O)CC6=CN=C(C=C6)F

InChI

InChI=1S/C25H27FN8O2/c26-21-2-1-17(12-28-21)15-32-5-3-19(4-6-32)34-16-29-22-24(33-7-9-36-10-8-33)30-23(31-25(22)34)18-11-20(35)14-27-13-18/h1-2,11-14,16,19,35H,3-10,15H2