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

Systemtic Name: (3S,4R)-2,2-dimethyl-4-phenyl-4-phenylsulfanyl-butane-1,3-diol Openeye Name: (3S,4R)-2,2-dimethyl-4-phenyl-4-phenylsulfanyl-butane-1,3-diol CAS Name: (3S,4R)-2,2-dimethyl-4-phenyl-4-(phenylthio)butane-1,3-diol IUPAC Name: (3S,4R)-2,2-dimethyl-4-phenyl-4-phenylsulfanylbutane-1,3-diol Traditional Name: (3S,4R)-2,2-dimethyl-4-phenyl-4-(phenylthio)butane-1,3-diol Formula: C18H22O2S MolecularWeight: 302.43108

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CO)C(C(C1=CC=CC=C1)SC2=CC=CC=C2)O

Isomeric SMILES

CC(C)(CO)[C@@H]([C@@H](C1=CC=CC=C1)SC2=CC=CC=C2)O

InChI

InChI=1S/C18H22O2S/c1-18(2,13-19)17(20)16(14-9-5-3-6-10-14)21-15-11-7-4-8-12-15/h3-12,16-17,19-20H,13H2,1-2H3/t16-,17-/m1/s1