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

Systemtic Name: 5-[6-(cyclopropylamino)-8-(3-fluorophenyl)purin-9-yl]-1-(2-hydroxyethyl)pyridin-2-one Openeye Name: 5-[6-(cyclopropylamino)-8-(3-fluorophenyl)purin-9-yl]-1-(2-hydroxyethyl)pyridin-2-one CAS Name: 5-[6-(cyclopropylamino)-8-(3-fluorophenyl)-9-purinyl]-1-(2-hydroxyethyl)-2-pyridinone IUPAC Name: 5-[6-(cyclopropylamino)-8-(3-fluorophenyl)purin-9-yl]-1-(2-hydroxyethyl)pyridin-2-one Traditional Name: 5-[6-(cyclopropylamino)-8-(3-fluorophenyl)purin-9-yl]-1-(2-hydroxyethyl)-2-pyridone Formula: C21H19FN6O2 MolecularWeight: 406.412963

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC2=NC=NC3=C2N=C(N3C4=CN(C(=O)C=C4)CCO)C5=CC(=CC=C5)F

Isomeric SMILES

C1CC1NC2=NC=NC3=C2N=C(N3C4=CN(C(=O)C=C4)CCO)C5=CC(=CC=C5)F

InChI

InChI=1S/C21H19FN6O2/c22-14-3-1-2-13(10-14)20-26-18-19(25-15-4-5-15)23-12-24-21(18)28(20)16-6-7-17(30)27(11-16)8-9-29/h1-3,6-7,10-12,15,29H,4-5,8-9H2,(H,23,24,25)