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

Systemtic Name: 5-[6-azanyl-8-(3-methoxyphenyl)purin-9-yl]-1-methyl-pyridin-2-one hydrochloride Openeye Name: 5-[6-amino-8-(3-methoxyphenyl)purin-9-yl]-1-methyl-pyridin-2-one hydrochloride CAS Name: 5-[6-amino-8-(3-methoxyphenyl)-9-purinyl]-1-methyl-2-pyridinone hydrochloride IUPAC Name: 5-[6-amino-8-(3-methoxyphenyl)purin-9-yl]-1-methylpyridin-2-one hydrochloride Traditional Name: 5-[6-amino-8-(3-methoxyphenyl)purin-9-yl]-1-methyl-2-pyridone hydrochloride Formula: C18H17ClN6O2 MolecularWeight: 384.81958

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H16N6O2.ClH/c1-23-9-12(6-7-14(23)25)24-17(11-4-3-5-13(8-11)26-2)22-15-16(19)20-10-21-18(15)24;/h3-10H,1-2H3,(H2,19,20,21);1H