9-(2-fluoranylpropyl)-8-(furan-2-yl)-N2-phenethyl-purine-2,6-diamine

Systemtic Name: 9-(2-fluoranylpropyl)-8-(furan-2-yl)-N2-phenethyl-purine-2,6-diamine Openeye Name: 9-(2-fluoropropyl)-8-(2-furyl)-N2-phenethyl-purine-2,6-diamine CAS Name: 9-(2-fluoropropyl)-8-(2-furanyl)-N2-phenethylpurine-2,6-diamine IUPAC Name: 9-(2-fluoropropyl)-8-(furan-2-yl)-2-N-phenethylpurine-2,6-diamine Traditional Name: [6-amino-9-(2-fluoropropyl)-8-(2-furyl)purin-2-yl]-phenethyl-amine Formula: C20H21FN6O MolecularWeight: 380.418743

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C2=C(C(=NC(=N2)NCCC3=CC=CC=C3)N)N=C1C4=CC=CO4)F

Isomeric SMILES

CC(CN1C2=C(C(=NC(=N2)NCCC3=CC=CC=C3)N)N=C1C4=CC=CO4)F

InChI

InChI=1S/C20H21FN6O/c1-13(21)12-27-18(15-8-5-11-28-15)24-16-17(22)25-20(26-19(16)27)23-10-9-14-6-3-2-4-7-14/h2-8,11,13H,9-10,12H2,1H3,(H3,22,23,25,26)