2-[6-(cyclopentylamino)purin-9-yl]-5-[2-(2-fluorophenyl)ethynyl]oxolane-3,4-diol

Systemtic Name: 2-[6-(cyclopentylamino)purin-9-yl]-5-[2-(2-fluorophenyl)ethynyl]oxolane-3,4-diol Openeye Name: 2-[6-(cyclopentylamino)purin-9-yl]-5-[2-(2-fluorophenyl)ethynyl]tetrahydrofuran-3,4-diol CAS Name: 2-[6-(cyclopentylamino)-9-purinyl]-5-[2-(2-fluorophenyl)ethynyl]oxolane-3,4-diol IUPAC Name: 2-[6-(cyclopentylamino)purin-9-yl]-5-[2-(2-fluorophenyl)ethynyl]oxolane-3,4-diol Traditional Name: 2-[6-(cyclopentylamino)purin-9-yl]-5-[2-(2-fluorophenyl)ethynyl]tetrahydrofuran-3,4-diol Formula: C22H22FN5O3 MolecularWeight: 423.440183

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC2=NC=NC3=C2N=CN3C4C(C(C(O4)C#CC5=CC=CC=C5F)O)O

Isomeric SMILES

C1CCC(C1)NC2=NC=NC3=C2N=CN3C4C(C(C(O4)C#CC5=CC=CC=C5F)O)O

InChI

InChI=1S/C22H22FN5O3/c23-15-8-4-1-5-13(15)9-10-16-18(29)19(30)22(31-16)28-12-26-17-20(24-11-25-21(17)28)27-14-6-2-3-7-14/h1,4-5,8,11-12,14,16,18-19,22,29-30H,2-3,6-7H2,(H,24,25,27)