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

Systemtic Name: 5-[6-(dimethylamino)-8-(3-fluorophenyl)purin-9-yl]-1-methyl-pyridin-2-one hydrochloride Openeye Name: 5-[6-(dimethylamino)-8-(3-fluorophenyl)purin-9-yl]-1-methyl-pyridin-2-one hydrochloride CAS Name: 5-[6-(dimethylamino)-8-(3-fluorophenyl)-9-purinyl]-1-methyl-2-pyridinone hydrochloride IUPAC Name: 5-[6-(dimethylamino)-8-(3-fluorophenyl)purin-9-yl]-1-methylpyridin-2-one hydrochloride Traditional Name: 5-[6-(dimethylamino)-8-(3-fluorophenyl)purin-9-yl]-1-methyl-2-pyridone hydrochloride Formula: C19H18ClFN6O MolecularWeight: 400.837223

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=CC1=O)N2C3=C(C(=NC=N3)N(C)C)N=C2C4=CC(=CC=C4)F.Cl

Isomeric SMILES

CN1C=C(C=CC1=O)N2C3=C(C(=NC=N3)N(C)C)N=C2C4=CC(=CC=C4)F.Cl

InChI

InChI=1S/C19H17FN6O.ClH/c1-24(2)18-16-19(22-11-21-18)26(14-7-8-15(27)25(3)10-14)17(23-16)12-5-4-6-13(20)9-12;/h4-11H,1-3H3;1H