5-[6-(cyclopropylamino)-8-(3-fluorophenyl)purin-9-yl]-1-methyl-pyridin-2-one

Systemtic Name: 5-[6-(cyclopropylamino)-8-(3-fluorophenyl)purin-9-yl]-1-methyl-pyridin-2-one Openeye Name: 5-[6-(cyclopropylamino)-8-(3-fluorophenyl)purin-9-yl]-1-methyl-pyridin-2-one CAS Name: 5-[6-(cyclopropylamino)-8-(3-fluorophenyl)-9-purinyl]-1-methyl-2-pyridinone IUPAC Name: 5-[6-(cyclopropylamino)-8-(3-fluorophenyl)purin-9-yl]-1-methylpyridin-2-one Traditional Name: 5-[6-(cyclopropylamino)-8-(3-fluorophenyl)purin-9-yl]-1-methyl-2-pyridone Formula: C20H17FN6O MolecularWeight: 376.386983

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=CC1=O)N2C3=C(C(=NC=N3)NC4CC4)N=C2C5=CC(=CC=C5)F

Isomeric SMILES

CN1C=C(C=CC1=O)N2C3=C(C(=NC=N3)NC4CC4)N=C2C5=CC(=CC=C5)F

InChI

InChI=1S/C20H17FN6O/c1-26-10-15(7-8-16(26)28)27-19(12-3-2-4-13(21)9-12)25-17-18(24-14-5-6-14)22-11-23-20(17)27/h2-4,7-11,14H,5-6H2,1H3,(H,22,23,24)