(2S,3S,4R)-2,4-dimethyl-4-phenylsulfanyl-hexane-1,3-diol

Systemtic Name: (2S,3S,4R)-2,4-dimethyl-4-phenylsulfanyl-hexane-1,3-diol Openeye Name: (2S,3S,4R)-2,4-dimethyl-4-phenylsulfanyl-hexane-1,3-diol CAS Name: (2S,3S,4R)-2,4-dimethyl-4-(phenylthio)hexane-1,3-diol IUPAC Name: (2S,3S,4R)-2,4-dimethyl-4-phenylsulfanylhexane-1,3-diol Traditional Name: (2S,3S,4R)-2,4-dimethyl-4-(phenylthio)hexane-1,3-diol Formula: C14H22O2S MolecularWeight: 254.38828

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H22O2S/c1-4-14(3,13(16)11(2)10-15)17-12-8-6-5-7-9-12/h5-9,11,13,15-16H,4,10H2,1-3H3/t11-,13-,14+/m0/s1