2-azanyl-7-[(4-fluorophenyl)methyl]-3H-purin-6-one hydrochloride

Systemtic Name: 2-azanyl-7-[(4-fluorophenyl)methyl]-3H-purin-6-one hydrochloride Openeye Name: 2-amino-7-[(4-fluorophenyl)methyl]-3H-purin-6-one hydrochloride CAS Name: 2-amino-7-[(4-fluorophenyl)methyl]-3H-purin-6-one hydrochloride IUPAC Name: 2-amino-7-[(4-fluorophenyl)methyl]-3H-purin-6-one hydrochloride Traditional Name: 2-amino-7-(4-fluorobenzyl)-3H-purin-6-one hydrochloride Formula: C12H11ClFN5O MolecularWeight: 295.700043

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN2C=NC3=C2C(=O)N=C(N3)N)F.Cl

Isomeric SMILES

C1=CC(=CC=C1CN2C=NC3=C2C(=O)N=C(N3)N)F.Cl

InChI

InChI=1S/C12H10FN5O.ClH/c13-8-3-1-7(2-4-8)5-18-6-15-10-9(18)11(19)17-12(14)16-10;/h1-4,6H,5H2,(H3,14,16,17,19);1H