2-[6-(cyclopentylmethylamino)-2-(3-phenoxyprop-1-ynyl)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol

Systemtic Name: 2-[6-(cyclopentylmethylamino)-2-(3-phenoxyprop-1-ynyl)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Openeye Name: 2-[6-(cyclopentylmethylamino)-2-(3-phenoxyprop-1-ynyl)purin-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol CAS Name: 2-[6-(cyclopentylmethylamino)-2-(3-phenoxyprop-1-ynyl)-9-purinyl]-5-(hydroxymethyl)oxolane-3,4-diol IUPAC Name: 2-[6-(cyclopentylmethylamino)-2-(3-phenoxyprop-1-ynyl)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Traditional Name: 2-[6-(cyclopentylmethylamino)-2-(3-phenoxyprop-1-ynyl)purin-9-yl]-5-methylol-tetrahydrofuran-3,4-diol Formula: C25H29N5O5 MolecularWeight: 479.52826

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CNC2=NC(=NC3=C2N=CN3C4C(C(C(O4)CO)O)O)C#CCOC5=CC=CC=C5

Isomeric SMILES

C1CCC(C1)CNC2=NC(=NC3=C2N=CN3C4C(C(C(O4)CO)O)O)C#CCOC5=CC=CC=C5

InChI

InChI=1S/C25H29N5O5/c31-14-18-21(32)22(33)25(35-18)30-15-27-20-23(26-13-16-7-4-5-8-16)28-19(29-24(20)30)11-6-12-34-17-9-2-1-3-10-17/h1-3,9-10,15-16,18,21-22,25,31-33H,4-5,7-8,12-14H2,(H,26,28,29)