9-ethyl-8-(4-fluoranyl-3-phenyl-pyrazol-1-yl)purine-2,6-diamine

Systemtic Name: 9-ethyl-8-(4-fluoranyl-3-phenyl-pyrazol-1-yl)purine-2,6-diamine Openeye Name: 9-ethyl-8-(4-fluoro-3-phenyl-pyrazol-1-yl)purine-2,6-diamine CAS Name: 9-ethyl-8-(4-fluoro-3-phenyl-1-pyrazolyl)purine-2,6-diamine IUPAC Name: 9-ethyl-8-(4-fluoro-3-phenylpyrazol-1-yl)purine-2,6-diamine Traditional Name: [2-amino-9-ethyl-8-(4-fluoro-3-phenyl-pyrazol-1-yl)purin-6-yl]amine Formula: C16H15FN8 MolecularWeight: 338.342303

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C(=NC(=N2)N)N)N=C1N3C=C(C(=N3)C4=CC=CC=C4)F

Isomeric SMILES

CCN1C2=C(C(=NC(=N2)N)N)N=C1N3C=C(C(=N3)C4=CC=CC=C4)F

InChI

InChI=1S/C16H15FN8/c1-2-24-14-12(13(18)21-15(19)22-14)20-16(24)25-8-10(17)11(23-25)9-6-4-3-5-7-9/h3-8H,2H2,1H3,(H4,18,19,21,22)