(2S,5R)-5-[6-(dimethylamino)-2-methylsulfanyl-purin-9-yl]-2-(hydroxymethyl)oxolan-3-ol

Systemtic Name: (2S,5R)-5-[6-(dimethylamino)-2-methylsulfanyl-purin-9-yl]-2-(hydroxymethyl)oxolan-3-ol Openeye Name: (2S,5R)-5-[6-(dimethylamino)-2-methylsulfanyl-purin-9-yl]-2-(hydroxymethyl)tetrahydrofuran-3-ol CAS Name: (2S,5R)-5-[6-(dimethylamino)-2-(methylthio)-9-purinyl]-2-(hydroxymethyl)-3-oxolanol IUPAC Name: (2S,5R)-5-[6-(dimethylamino)-2-methylsulfanylpurin-9-yl]-2-(hydroxymethyl)oxolan-3-ol Traditional Name: (2S,5R)-5-[6-(dimethylamino)-2-(methylthio)purin-9-yl]-2-methylol-tetrahydrofuran-3-ol Formula: C13H19N5O3S MolecularWeight: 325.38666

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC(=NC2=C1N=CN2C3CC(C(O3)CO)O)SC

Isomeric SMILES

CN(C)C1=NC(=NC2=C1N=CN2[C@H]3CC([C@@H](O3)CO)O)SC

InChI

InChI=1S/C13H19N5O3S/c1-17(2)11-10-12(16-13(15-11)22-3)18(6-14-10)9-4-7(20)8(5-19)21-9/h6-9,19-20H,4-5H2,1-3H3/t7?,8-,9+/m0/s1