[(2S,5R)-5-(6-aminopurin-9-yl)-2,5-dihydrofuran-2-yl]methyl methanesulfonate

Systemtic Name: [(2S,5R)-5-(6-aminopurin-9-yl)-2,5-dihydrofuran-2-yl]methyl methanesulfonate Openeye Name: [(2S,5R)-5-(6-aminopurin-9-yl)-2,5-dihydrofuran-2-yl]methyl methanesulfonate CAS Name: methanesulfonic acid [(2S,5R)-5-(6-aminopurin-9-yl)-2,5-dihydrofuran-2-yl]methyl ester IUPAC Name: [(2S,5R)-5-(6-aminopurin-9-yl)-2,5-dihydrofuran-2-yl]methyl methanesulfonate Traditional Name: methanesulfonic acid [(2S,5R)-5-adenin-9-yl-2,5-dihydrofuran-2-yl]methyl ester Formula: C11H13N5O4S MolecularWeight: 311.31702

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OCC1C=CC(O1)N2C=NC3=C2N=CN=C3N

Isomeric SMILES

CS(=O)(=O)OC[C@@H]1C=C[C@@H](O1)N2C=NC3=C2N=CN=C3N

InChI

InChI=1S/C11H13N5O4S/c1-21(17,18)19-4-7-2-3-8(20-7)16-6-15-9-10(12)13-5-14-11(9)16/h2-3,5-8H,4H2,1H3,(H2,12,13,14)/t7-,8+/m0/s1