[2-(6-aminopurin-9-yl)-5-(hydroxymethyl)-4-oxidanyl-thiolan-3-yl] methanesulfonate

Systemtic Name: [2-(6-aminopurin-9-yl)-5-(hydroxymethyl)-4-oxidanyl-thiolan-3-yl] methanesulfonate Openeye Name: [2-(6-aminopurin-9-yl)-4-hydroxy-5-(hydroxymethyl)tetrahydrothiophen-3-yl] methanesulfonate CAS Name: methanesulfonic acid [2-(6-aminopurin-9-yl)-4-hydroxy-5-(hydroxymethyl)-3-thiolanyl] ester IUPAC Name: [2-(6-aminopurin-9-yl)-4-hydroxy-5-(hydroxymethyl)thiolan-3-yl] methanesulfonate Traditional Name: methanesulfonic acid (2-adenin-9-yl-4-hydroxy-5-methylol-tetrahydrothiophen-3-yl) ester Formula: C11H15N5O5S2 MolecularWeight: 361.3973

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC1C(C(SC1N2C=NC3=C2N=CN=C3N)CO)O

Isomeric SMILES

CS(=O)(=O)OC1C(C(SC1N2C=NC3=C2N=CN=C3N)CO)O

InChI

InChI=1S/C11H15N5O5S2/c1-23(19,20)21-8-7(18)5(2-17)22-11(8)16-4-15-6-9(12)13-3-14-10(6)16/h3-5,7-8,11,17-18H,2H2,1H3,(H2,12,13,14)