S-[(3R,4R,5R,6S)-6-methoxy-4,5-bis-(4-methylphenyl)sulfonyloxy-oxan-3-yl] ethanethioate

Systemtic Name: S-[(3R,4R,5R,6S)-6-methoxy-4,5-bis-(4-methylphenyl)sulfonyloxy-oxan-3-yl] ethanethioate Openeye Name: S-[(3R,4R,5R,6S)-6-methoxy-4,5-bis(p-tolylsulfonyloxy)tetrahydropyran-3-yl] ethanethioate CAS Name: ethanethioic acid S-[(3R,4R,5R,6S)-6-methoxy-4,5-bis-(4-methylphenyl)sulfonyloxy-3-oxanyl] ester IUPAC Name: S-[(3R,4R,5R,6S)-6-methoxy-4,5-bis-(4-methylphenyl)sulfonyloxyoxan-3-yl] ethanethioate Traditional Name: ethanethioic acid S-[(3R,4R,5R,6S)-6-methoxy-4,5-ditosyloxy-tetrahydropyran-3-yl] ester Formula: C22H26O9S3 MolecularWeight: 530.63144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2C(COC(C2OS(=O)(=O)C3=CC=C(C=C3)C)OC)SC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O[C@H]2[C@@H](CO[C@@H]([C@@H]2OS(=O)(=O)C3=CC=C(C=C3)C)OC)SC(=O)C

InChI

InChI=1S/C22H26O9S3/c1-14-5-9-17(10-6-14)33(24,25)30-20-19(32-16(3)23)13-29-22(28-4)21(20)31-34(26,27)18-11-7-15(2)8-12-18/h5-12,19-22H,13H2,1-4H3/t19-,20+,21-,22+/m1/s1