[(2S,3S,4R,6S)-2-ethyl-3,6-dimethyl-thian-4-yl] ethanoate

Systemtic Name: [(2S,3S,4R,6S)-2-ethyl-3,6-dimethyl-thian-4-yl] ethanoate Openeye Name: [(2S,3S,4R,6S)-2-ethyl-3,6-dimethyl-tetrahydrothiopyran-4-yl] acetate CAS Name: acetic acid [(2S,3S,4R,6S)-2-ethyl-3,6-dimethyl-4-thianyl] ester IUPAC Name: [(2S,3S,4R,6S)-2-ethyl-3,6-dimethylthian-4-yl] acetate Traditional Name: acetic acid [(2S,3S,4R,6S)-2-ethyl-3,6-dimethyl-tetrahydrothiopyran-4-yl] ester Formula: C11H20O2S MolecularWeight: 216.3403

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1C(C(CC(S1)C)OC(=O)C)C

Isomeric SMILES

CC[C@H]1[C@H]([C@@H](C[C@@H](S1)C)OC(=O)C)C

InChI

InChI=1S/C11H20O2S/c1-5-11-8(3)10(13-9(4)12)6-7(2)14-11/h7-8,10-11H,5-6H2,1-4H3/t7-,8-,10+,11-/m0/s1