2-[6-(cyclohexylamino)purin-9-yl]-5-[(2-fluoranylphenoxy)methyl]oxolane-3,4-diol

Systemtic Name: 2-[6-(cyclohexylamino)purin-9-yl]-5-[(2-fluoranylphenoxy)methyl]oxolane-3,4-diol Openeye Name: 2-[6-(cyclohexylamino)purin-9-yl]-5-[(2-fluorophenoxy)methyl]tetrahydrofuran-3,4-diol CAS Name: 2-[6-(cyclohexylamino)-9-purinyl]-5-[(2-fluorophenoxy)methyl]oxolane-3,4-diol IUPAC Name: 2-[6-(cyclohexylamino)purin-9-yl]-5-[(2-fluorophenoxy)methyl]oxolane-3,4-diol Traditional Name: 2-[6-(cyclohexylamino)purin-9-yl]-5-[(2-fluorophenoxy)methyl]tetrahydrofuran-3,4-diol Formula: C22H26FN5O4 MolecularWeight: 443.471343

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC2=NC=NC3=C2N=CN3C4C(C(C(O4)COC5=CC=CC=C5F)O)O

Isomeric SMILES

C1CCC(CC1)NC2=NC=NC3=C2N=CN3C4C(C(C(O4)COC5=CC=CC=C5F)O)O

InChI

InChI=1S/C22H26FN5O4/c23-14-8-4-5-9-15(14)31-10-16-18(29)19(30)22(32-16)28-12-26-17-20(24-11-25-21(17)28)27-13-6-2-1-3-7-13/h4-5,8-9,11-13,16,18-19,22,29-30H,1-3,6-7,10H2,(H,24,25,27)