(2S,3S,4R)-2,4,7-trimethyl-4-phenylsulfanyl-octane-1,3-diol

Systemtic Name: (2S,3S,4R)-2,4,7-trimethyl-4-phenylsulfanyl-octane-1,3-diol Openeye Name: (2S,3S,4R)-2,4,7-trimethyl-4-phenylsulfanyl-octane-1,3-diol CAS Name: (2S,3S,4R)-2,4,7-trimethyl-4-(phenylthio)octane-1,3-diol IUPAC Name: (2S,3S,4R)-2,4,7-trimethyl-4-phenylsulfanyloctane-1,3-diol Traditional Name: (2S,3S,4R)-2,4,7-trimethyl-4-(phenylthio)octane-1,3-diol Formula: C17H28O2S MolecularWeight: 296.46802

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H28O2S/c1-13(2)10-11-17(4,16(19)14(3)12-18)20-15-8-6-5-7-9-15/h5-9,13-14,16,18-19H,10-12H2,1-4H3/t14-,16-,17+/m0/s1