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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C(=NC(=N2)NCCC3=CC=C(C=C3)F)N)N=C1N4C=CC=N4

Isomeric SMILES

CCN1C2=C(C(=NC(=N2)NCCC3=CC=C(C=C3)F)N)N=C1N4C=CC=N4

InChI

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