9-(2-fluoranylpropyl)-N2-phenethyl-purine-2,6-diamine

Systemtic Name: 9-(2-fluoranylpropyl)-N2-phenethyl-purine-2,6-diamine Openeye Name: 9-(2-fluoropropyl)-N2-phenethyl-purine-2,6-diamine CAS Name: 9-(2-fluoropropyl)-N2-phenethylpurine-2,6-diamine IUPAC Name: 9-(2-fluoropropyl)-2-N-phenethylpurine-2,6-diamine Traditional Name: [6-amino-9-(2-fluoropropyl)purin-2-yl]-phenethyl-amine Formula: C16H19FN6 MolecularWeight: 314.360663

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C=NC2=C1N=C(N=C2N)NCCC3=CC=CC=C3)F

Isomeric SMILES

CC(CN1C=NC2=C1N=C(N=C2N)NCCC3=CC=CC=C3)F

InChI

InChI=1S/C16H19FN6/c1-11(17)9-23-10-20-13-14(18)21-16(22-15(13)23)19-8-7-12-5-3-2-4-6-12/h2-6,10-11H,7-9H2,1H3,(H3,18,19,21,22)