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

Systemtic Name: N2-[(4-fluorophenyl)methyl]-9-propan-2-yl-8-pyrazol-1-yl-purine-2,6-diamine Openeye Name: N2-[(4-fluorophenyl)methyl]-9-isopropyl-8-pyrazol-1-yl-purine-2,6-diamine CAS Name: N2-[(4-fluorophenyl)methyl]-9-propan-2-yl-8-(1-pyrazolyl)purine-2,6-diamine IUPAC Name: 2-N-[(4-fluorophenyl)methyl]-9-propan-2-yl-8-pyrazol-1-ylpurine-2,6-diamine Traditional Name: (6-amino-9-isopropyl-8-pyrazol-1-yl-purin-2-yl)-(4-fluorobenzyl)amine Formula: C18H19FN8 MolecularWeight: 366.395463

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=C(C(=NC(=N2)NCC3=CC=C(C=C3)F)N)N=C1N4C=CC=N4

Isomeric SMILES

CC(C)N1C2=C(C(=NC(=N2)NCC3=CC=C(C=C3)F)N)N=C1N4C=CC=N4

InChI

InChI=1S/C18H19FN8/c1-11(2)27-16-14(23-18(27)26-9-3-8-22-26)15(20)24-17(25-16)21-10-12-4-6-13(19)7-5-12/h3-9,11H,10H2,1-2H3,(H3,20,21,24,25)