2-(hydroxymethyl)-5-[6-[(1-phenylcyclobutyl)methylamino]purin-9-yl]oxolane-3,4-diol

Systemtic Name: 2-(hydroxymethyl)-5-[6-[(1-phenylcyclobutyl)methylamino]purin-9-yl]oxolane-3,4-diol Openeye Name: 2-(hydroxymethyl)-5-[6-[(1-phenylcyclobutyl)methylamino]purin-9-yl]tetrahydrofuran-3,4-diol CAS Name: 2-(hydroxymethyl)-5-[6-[(1-phenylcyclobutyl)methylamino]-9-purinyl]oxolane-3,4-diol IUPAC Name: 2-(hydroxymethyl)-5-[6-[(1-phenylcyclobutyl)methylamino]purin-9-yl]oxolane-3,4-diol Traditional Name: 2-methylol-5-[6-[(1-phenylcyclobutyl)methylamino]purin-9-yl]tetrahydrofuran-3,4-diol Formula: C21H25N5O4 MolecularWeight: 411.4543

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)(CNC2=NC=NC3=C2N=CN3C4C(C(C(O4)CO)O)O)C5=CC=CC=C5

Isomeric SMILES

C1CC(C1)(CNC2=NC=NC3=C2N=CN3C4C(C(C(O4)CO)O)O)C5=CC=CC=C5

InChI

InChI=1S/C21H25N5O4/c27-9-14-16(28)17(29)20(30-14)26-12-25-15-18(23-11-24-19(15)26)22-10-21(7-4-8-21)13-5-2-1-3-6-13/h1-3,5-6,11-12,14,16-17,20,27-29H,4,7-10H2,(H,22,23,24)