2-[8-(dimethylamino)-6-(methylamino)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol

Systemtic Name: 2-[8-(dimethylamino)-6-(methylamino)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Openeye Name: 2-[8-(dimethylamino)-6-(methylamino)purin-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol CAS Name: 2-[8-(dimethylamino)-6-(methylamino)-9-purinyl]-5-(hydroxymethyl)oxolane-3,4-diol IUPAC Name: 2-[8-(dimethylamino)-6-(methylamino)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Traditional Name: 2-[8-(dimethylamino)-6-(methylamino)purin-9-yl]-5-methylol-tetrahydrofuran-3,4-diol Formula: C13H20N6O4 MolecularWeight: 324.3357

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC=NC2=C1N=C(N2C3C(C(C(O3)CO)O)O)N(C)C

Isomeric SMILES

CNC1=NC=NC2=C1N=C(N2C3C(C(C(O3)CO)O)O)N(C)C

InChI

InChI=1S/C13H20N6O4/c1-14-10-7-11(16-5-15-10)19(13(17-7)18(2)3)12-9(22)8(21)6(4-20)23-12/h5-6,8-9,12,20-22H,4H2,1-3H3,(H,14,15,16)