[(3R,4S,5R)-4,5-diacetyloxy-6-(phenylmethylsulfanyl)thian-3-yl] ethanoate

Systemtic Name: [(3R,4S,5R)-4,5-diacetyloxy-6-(phenylmethylsulfanyl)thian-3-yl] ethanoate Openeye Name: [(3R,4S,5R)-4,5-diacetoxy-6-benzylsulfanyl-tetrahydrothiopyran-3-yl] acetate CAS Name: acetic acid [(3R,4S,5R)-4,5-diacetyloxy-6-(phenylmethylthio)-3-thianyl] ester IUPAC Name: [(3R,4S,5R)-4,5-diacetyloxy-6-benzylsulfanylthian-3-yl] acetate Traditional Name: acetic acid [(3R,4S,5R)-4,5-diacetoxy-6-(benzylthio)tetrahydrothiopyran-3-yl] ester Formula: C18H22O6S2 MolecularWeight: 398.49368

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CSC(C(C1OC(=O)C)OC(=O)C)SCC2=CC=CC=C2

Isomeric SMILES

CC(=O)O[C@H]1CSC([C@@H]([C@H]1OC(=O)C)OC(=O)C)SCC2=CC=CC=C2

InChI

InChI=1S/C18H22O6S2/c1-11(19)22-15-10-26-18(25-9-14-7-5-4-6-8-14)17(24-13(3)21)16(15)23-12(2)20/h4-8,15-18H,9-10H2,1-3H3/t15-,16-,17+,18?/m0/s1