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

Systemtic Name: (2S,5R)-5-[2-bromanyl-6-(methylamino)purin-9-yl]-2-(hydroxymethyl)oxolan-3-ol Openeye Name: (2S,5R)-5-[2-bromo-6-(methylamino)purin-9-yl]-2-(hydroxymethyl)tetrahydrofuran-3-ol CAS Name: (2S,5R)-5-[2-bromo-6-(methylamino)-9-purinyl]-2-(hydroxymethyl)-3-oxolanol IUPAC Name: (2S,5R)-5-[2-bromo-6-(methylamino)purin-9-yl]-2-(hydroxymethyl)oxolan-3-ol Traditional Name: (2S,5R)-5-[2-bromo-6-(methylamino)purin-9-yl]-2-methylol-tetrahydrofuran-3-ol Formula: C11H14BrN5O3 MolecularWeight: 344.16456

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC(=NC2=C1N=CN2C3CC(C(O3)CO)O)Br

Isomeric SMILES

CNC1=NC(=NC2=C1N=CN2[C@H]3CC([C@@H](O3)CO)O)Br

InChI

InChI=1S/C11H14BrN5O3/c1-13-9-8-10(16-11(12)15-9)17(4-14-8)7-2-5(19)6(3-18)20-7/h4-7,18-19H,2-3H2,1H3,(H,13,15,16)/t5?,6-,7+/m0/s1