N2-[(4-fluorophenyl)methyl]-9-methyl-8-pyrazol-1-yl-purine-2,6-diamine

Systemtic Name: N2-[(4-fluorophenyl)methyl]-9-methyl-8-pyrazol-1-yl-purine-2,6-diamine Openeye Name: N2-[(4-fluorophenyl)methyl]-9-methyl-8-pyrazol-1-yl-purine-2,6-diamine CAS Name: N2-[(4-fluorophenyl)methyl]-9-methyl-8-(1-pyrazolyl)purine-2,6-diamine IUPAC Name: 2-N-[(4-fluorophenyl)methyl]-9-methyl-8-pyrazol-1-ylpurine-2,6-diamine Traditional Name: (6-amino-9-methyl-8-pyrazol-1-yl-purin-2-yl)-(4-fluorobenzyl)amine Formula: C16H15FN8 MolecularWeight: 338.342303

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=NC(=N2)NCC3=CC=C(C=C3)F)N)N=C1N4C=CC=N4

Isomeric SMILES

CN1C2=C(C(=NC(=N2)NCC3=CC=C(C=C3)F)N)N=C1N4C=CC=N4

InChI

InChI=1S/C16H15FN8/c1-24-14-12(21-16(24)25-8-2-7-20-25)13(18)22-15(23-14)19-9-10-3-5-11(17)6-4-10/h2-8H,9H2,1H3,(H3,18,19,22,23)