N6-[(4-fluorophenyl)methyl]-7H-purine-2,6-diamine

Systemtic Name: N6-[(4-fluorophenyl)methyl]-7H-purine-2,6-diamine Openeye Name: N6-[(4-fluorophenyl)methyl]-7H-purine-2,6-diamine CAS Name: N6-[(4-fluorophenyl)methyl]-7H-purine-2,6-diamine IUPAC Name: 6-N-[(4-fluorophenyl)methyl]-7H-purine-2,6-diamine Traditional Name: (2-amino-7H-purin-6-yl)-(4-fluorobenzyl)amine Formula: C12H11FN6 MolecularWeight: 258.254343

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC2=NC(=NC3=C2NC=N3)N)F

Isomeric SMILES

C1=CC(=CC=C1CNC2=NC(=NC3=C2NC=N3)N)F

InChI

InChI=1S/C12H11FN6/c13-8-3-1-7(2-4-8)5-15-10-9-11(17-6-16-9)19-12(14)18-10/h1-4,6H,5H2,(H4,14,15,16,17,18,19)