thian-4-yl methanesulfonate

Systemtic Name: thian-4-yl methanesulfonate Openeye Name: tetrahydrothiopyran-4-yl methanesulfonate CAS Name: methanesulfonic acid 4-thianyl ester IUPAC Name: thian-4-yl methanesulfonate Traditional Name: methanesulfonic acid tetrahydrothiopyran-4-yl ester Formula: C6H12O3S2 MolecularWeight: 196.28768

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC1CCSCC1

Isomeric SMILES

CS(=O)(=O)OC1CCSCC1

InChI

InChI=1S/C6H12O3S2/c1-11(7,8)9-6-2-4-10-5-3-6/h6H,2-5H2,1H3