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

Systemtic Name: 9-ethyl-N2-[(4-fluorophenyl)methyl]-8-pyrazol-1-yl-purine-2,6-diamine Openeye Name: 9-ethyl-N2-[(4-fluorophenyl)methyl]-8-pyrazol-1-yl-purine-2,6-diamine CAS Name: 9-ethyl-N2-[(4-fluorophenyl)methyl]-8-(1-pyrazolyl)purine-2,6-diamine IUPAC Name: 9-ethyl-2-N-[(4-fluorophenyl)methyl]-8-pyrazol-1-ylpurine-2,6-diamine Traditional Name: (6-amino-9-ethyl-8-pyrazol-1-yl-purin-2-yl)-(4-fluorobenzyl)amine Formula: C17H17FN8 MolecularWeight: 352.368883

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C(=NC(=N2)NCC3=CC=C(C=C3)F)N)N=C1N4C=CC=N4

Isomeric SMILES

CCN1C2=C(C(=NC(=N2)NCC3=CC=C(C=C3)F)N)N=C1N4C=CC=N4

InChI

InChI=1S/C17H17FN8/c1-2-25-15-13(22-17(25)26-9-3-8-21-26)14(19)23-16(24-15)20-10-11-4-6-12(18)7-5-11/h3-9H,2,10H2,1H3,(H3,19,20,23,24)