2-(hydroxymethyl)-5-[8-[(phenylmethyl)-propan-2-yl-amino]purin-9-yl]oxolane-3,4-diol

Systemtic Name: 2-(hydroxymethyl)-5-[8-[(phenylmethyl)-propan-2-yl-amino]purin-9-yl]oxolane-3,4-diol Openeye Name: 2-[8-[benzyl(isopropyl)amino]purin-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol CAS Name: 2-(hydroxymethyl)-5-[8-[(phenylmethyl)-propan-2-ylamino]-9-purinyl]oxolane-3,4-diol IUPAC Name: 2-[8-[benzyl(propan-2-yl)amino]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Traditional Name: 2-[8-[benzyl(isopropyl)amino]purin-9-yl]-5-methylol-tetrahydrofuran-3,4-diol Formula: C20H25N5O4 MolecularWeight: 399.4436

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC1=CC=CC=C1)C2=NC3=CN=CN=C3N2C4C(C(C(O4)CO)O)O

Isomeric SMILES

CC(C)N(CC1=CC=CC=C1)C2=NC3=CN=CN=C3N2C4C(C(C(O4)CO)O)O

InChI

InChI=1S/C20H25N5O4/c1-12(2)24(9-13-6-4-3-5-7-13)20-23-14-8-21-11-22-18(14)25(20)19-17(28)16(27)15(10-26)29-19/h3-8,11-12,15-17,19,26-28H,9-10H2,1-2H3