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

Systemtic Name: 2-(hydroxymethyl)-5-[6-(1-phenoxypropan-2-ylamino)purin-9-yl]oxolane-3,4-diol Openeye Name: 2-(hydroxymethyl)-5-[6-[(1-methyl-2-phenoxy-ethyl)amino]purin-9-yl]tetrahydrofuran-3,4-diol CAS Name: 2-(hydroxymethyl)-5-[6-(1-phenoxypropan-2-ylamino)-9-purinyl]oxolane-3,4-diol IUPAC Name: 2-(hydroxymethyl)-5-[6-(1-phenoxypropan-2-ylamino)purin-9-yl]oxolane-3,4-diol Traditional Name: 2-methylol-5-[6-[(1-methyl-2-phenoxy-ethyl)amino]purin-9-yl]tetrahydrofuran-3,4-diol Formula: C19H23N5O5 MolecularWeight: 401.41642

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC1=CC=CC=C1)NC2=NC=NC3=C2N=CN3C4C(C(C(O4)CO)O)O

Isomeric SMILES

CC(COC1=CC=CC=C1)NC2=NC=NC3=C2N=CN3C4C(C(C(O4)CO)O)O

InChI

InChI=1S/C19H23N5O5/c1-11(8-28-12-5-3-2-4-6-12)23-17-14-18(21-9-20-17)24(10-22-14)19-16(27)15(26)13(7-25)29-19/h2-6,9-11,13,15-16,19,25-27H,7-8H2,1H3,(H,20,21,23)