(2R,4R)-5-methyl-5-phenylsulfanyl-hexane-1,2,4-triol

Systemtic Name: (2R,4R)-5-methyl-5-phenylsulfanyl-hexane-1,2,4-triol Openeye Name: (2R,4R)-5-methyl-5-phenylsulfanyl-hexane-1,2,4-triol CAS Name: (2R,4R)-5-methyl-5-(phenylthio)hexane-1,2,4-triol IUPAC Name: (2R,4R)-5-methyl-5-phenylsulfanylhexane-1,2,4-triol Traditional Name: (2R,4R)-5-methyl-5-(phenylthio)hexane-1,2,4-triol Formula: C13H20O3S MolecularWeight: 256.3611

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(CC(CO)O)O)SC1=CC=CC=C1

Isomeric SMILES

CC(C)([C@@H](C[C@H](CO)O)O)SC1=CC=CC=C1

InChI

InChI=1S/C13H20O3S/c1-13(2,12(16)8-10(15)9-14)17-11-6-4-3-5-7-11/h3-7,10,12,14-16H,8-9H2,1-2H3/t10-,12-/m1/s1