[(2R,3R,5R)-5-(6-benzamidopurin-9-yl)-3-methylsulfonyloxy-oxolan-2-yl]methyl methanesulfonate

Systemtic Name: [(2R,3R,5R)-5-(6-benzamidopurin-9-yl)-3-methylsulfonyloxy-oxolan-2-yl]methyl methanesulfonate Openeye Name: [(2R,3R,5R)-5-(6-benzamidopurin-9-yl)-3-methylsulfonyloxy-tetrahydrofuran-2-yl]methyl methanesulfonate CAS Name: methanesulfonic acid [(2R,3R,5R)-5-(6-benzamido-9-purinyl)-3-methylsulfonyloxy-2-oxolanyl]methyl ester IUPAC Name: [(2R,3R,5R)-5-(6-benzamidopurin-9-yl)-3-methylsulfonyloxyoxolan-2-yl]methyl methanesulfonate Traditional Name: methanesulfonic acid [(2R,3R,5R)-5-(6-benzamidopurin-9-yl)-3-methylsulfonyloxy-tetrahydrofuran-2-yl]methyl ester Formula: C19H21N5O8S2 MolecularWeight: 511.52874

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OCC1C(CC(O1)N2C=NC3=C2N=CN=C3NC(=O)C4=CC=CC=C4)OS(=O)(=O)C

Isomeric SMILES

CS(=O)(=O)OC[C@@H]1[C@@H](C[C@@H](O1)N2C=NC3=C2N=CN=C3NC(=O)C4=CC=CC=C4)OS(=O)(=O)C

InChI

InChI=1S/C19H21N5O8S2/c1-33(26,27)30-9-14-13(32-34(2,28)29)8-15(31-14)24-11-22-16-17(20-10-21-18(16)24)23-19(25)12-6-4-3-5-7-12/h3-7,10-11,13-15H,8-9H2,1-2H3,(H,20,21,23,25)/t13-,14-,15-/m1/s1