(3R,4R)-2-methyl-3-[(4-methylphenyl)sulfonyl-methylsulfanyl-methyl]hexane-2,4-diol

Systemtic Name: (3R,4R)-2-methyl-3-[(4-methylphenyl)sulfonyl-methylsulfanyl-methyl]hexane-2,4-diol Openeye Name: (3R,4R)-2-methyl-3-[methylsulfanyl(p-tolylsulfonyl)methyl]hexane-2,4-diol CAS Name: (3R,4R)-2-methyl-3-[(4-methylphenyl)sulfonyl-(methylthio)methyl]hexane-2,4-diol IUPAC Name: (3R,4R)-2-methyl-3-[(4-methylphenyl)sulfonyl-methylsulfanylmethyl]hexane-2,4-diol Traditional Name: (3R,4R)-2-methyl-3-[(methylthio)-tosyl-methyl]hexane-2,4-diol Formula: C16H26O4S2 MolecularWeight: 346.50524

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C(SC)S(=O)(=O)C1=CC=C(C=C1)C)C(C)(C)O)O

Isomeric SMILES

CC[C@H]([C@@H](C(SC)S(=O)(=O)C1=CC=C(C=C1)C)C(C)(C)O)O

InChI

InChI=1S/C16H26O4S2/c1-6-13(17)14(16(3,4)18)15(21-5)22(19,20)12-9-7-11(2)8-10-12/h7-10,13-15,17-18H,6H2,1-5H3/t13-,14+,15?/m1/s1