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

Systemtic Name: (2S,3S)-2,4-dimethyl-4-phenylsulfanyl-pentane-1,3-diol Openeye Name: (2S,3S)-2,4-dimethyl-4-phenylsulfanyl-pentane-1,3-diol CAS Name: (2S,3S)-2,4-dimethyl-4-(phenylthio)pentane-1,3-diol IUPAC Name: (2S,3S)-2,4-dimethyl-4-phenylsulfanylpentane-1,3-diol Traditional Name: (2S,3S)-2,4-dimethyl-4-(phenylthio)pentane-1,3-diol Formula: C13H20O2S MolecularWeight: 240.3617

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H20O2S/c1-10(9-14)12(15)13(2,3)16-11-7-5-4-6-8-11/h4-8,10,12,14-15H,9H2,1-3H3/t10-,12-/m0/s1