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

Systemtic Name: 2-[6-(cyclopentylamino)purin-9-yl]-5-(2-phenylethynyl)oxolane-3,4-diol Openeye Name: 2-[6-(cyclopentylamino)purin-9-yl]-5-(2-phenylethynyl)tetrahydrofuran-3,4-diol CAS Name: 2-[6-(cyclopentylamino)-9-purinyl]-5-(2-phenylethynyl)oxolane-3,4-diol IUPAC Name: 2-[6-(cyclopentylamino)purin-9-yl]-5-(2-phenylethynyl)oxolane-3,4-diol Traditional Name: 2-[6-(cyclopentylamino)purin-9-yl]-5-(2-phenylethynyl)tetrahydrofuran-3,4-diol Formula: C22H23N5O3 MolecularWeight: 405.44972

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC2=NC=NC3=C2N=CN3C4C(C(C(O4)C#CC5=CC=CC=C5)O)O

Isomeric SMILES

C1CCC(C1)NC2=NC=NC3=C2N=CN3C4C(C(C(O4)C#CC5=CC=CC=C5)O)O

InChI

InChI=1S/C22H23N5O3/c28-18-16(11-10-14-6-2-1-3-7-14)30-22(19(18)29)27-13-25-17-20(23-12-24-21(17)27)26-15-8-4-5-9-15/h1-3,6-7,12-13,15-16,18-19,22,28-29H,4-5,8-9H2,(H,23,24,26)