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

Systemtic Name: 2-azanyl-7-[(4-fluorophenyl)methyl]-3H-purin-6-one Openeye Name: 2-amino-7-[(4-fluorophenyl)methyl]-3H-purin-6-one CAS Name: 2-amino-7-[(4-fluorophenyl)methyl]-3H-purin-6-one IUPAC Name: 2-amino-7-[(4-fluorophenyl)methyl]-3H-purin-6-one Traditional Name: 2-amino-7-(4-fluorobenzyl)-3H-purin-6-one Formula: C12H10FN5O MolecularWeight: 259.239103

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H10FN5O/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)