2,8-bis(azanyl)-9-[(4-fluorophenyl)methyl]-3H-purin-6-one

Systemtic Name: 2,8-bis(azanyl)-9-[(4-fluorophenyl)methyl]-3H-purin-6-one Openeye Name: 2,8-diamino-9-[(4-fluorophenyl)methyl]-3H-purin-6-one CAS Name: 2,8-diamino-9-[(4-fluorophenyl)methyl]-3H-purin-6-one IUPAC Name: 2,8-diamino-9-[(4-fluorophenyl)methyl]-3H-purin-6-one Traditional Name: 2,8-diamino-9-(4-fluorobenzyl)-3H-purin-6-one Formula: C12H11FN6O MolecularWeight: 274.253743

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN2C3=C(C(=O)N=C(N3)N)N=C2N)F

Isomeric SMILES

C1=CC(=CC=C1CN2C3=C(C(=O)N=C(N3)N)N=C2N)F

InChI

InChI=1S/C12H11FN6O/c13-7-3-1-6(2-4-7)5-19-9-8(16-12(19)15)10(20)18-11(14)17-9/h1-4H,5H2,(H2,15,16)(H3,14,17,18,20)