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

Systemtic Name: 5-[6-azanyl-8-(3-chlorophenyl)purin-9-yl]-1-methyl-pyridin-2-one hydrochloride Openeye Name: 5-[6-amino-8-(3-chlorophenyl)purin-9-yl]-1-methyl-pyridin-2-one hydrochloride CAS Name: 5-[6-amino-8-(3-chlorophenyl)-9-purinyl]-1-methyl-2-pyridinone hydrochloride IUPAC Name: 5-[6-amino-8-(3-chlorophenyl)purin-9-yl]-1-methylpyridin-2-one hydrochloride Traditional Name: 5-[6-amino-8-(3-chlorophenyl)purin-9-yl]-1-methyl-2-pyridone hydrochloride Formula: C17H14Cl2N6O MolecularWeight: 389.23866

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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)Cl.Cl

Isomeric SMILES

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

InChI

InChI=1S/C17H13ClN6O.ClH/c1-23-8-12(5-6-13(23)25)24-16(10-3-2-4-11(18)7-10)22-14-15(19)20-9-21-17(14)24;/h2-9H,1H3,(H2,19,20,21);1H