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

Systemtic Name: 2-[6-(cyclopentylamino)purin-9-yl]-5-(2-pyridin-2-ylethynyl)oxolane-3,4-diol Openeye Name: 2-[6-(cyclopentylamino)purin-9-yl]-5-[2-(2-pyridyl)ethynyl]tetrahydrofuran-3,4-diol CAS Name: 2-[6-(cyclopentylamino)-9-purinyl]-5-[2-(2-pyridinyl)ethynyl]oxolane-3,4-diol IUPAC Name: 2-[6-(cyclopentylamino)purin-9-yl]-5-(2-pyridin-2-ylethynyl)oxolane-3,4-diol Traditional Name: 2-[6-(cyclopentylamino)purin-9-yl]-5-[2-(2-pyridyl)ethynyl]tetrahydrofuran-3,4-diol Formula: C21H22N6O3 MolecularWeight: 406.43778

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC2=NC=NC3=C2N=CN3C4C(C(C(O4)C#CC5=CC=CC=N5)O)O

Isomeric SMILES

C1CCC(C1)NC2=NC=NC3=C2N=CN3C4C(C(C(O4)C#CC5=CC=CC=N5)O)O

InChI

InChI=1S/C21H22N6O3/c28-17-15(9-8-13-5-3-4-10-22-13)30-21(18(17)29)27-12-25-16-19(23-11-24-20(16)27)26-14-6-1-2-7-14/h3-5,10-12,14-15,17-18,21,28-29H,1-2,6-7H2,(H,23,24,26)