S-phenyl (2S,3S,4R)-2,4-dimethyl-3-oxidanyl-4-phenylsulfanyl-hexanethioate

Systemtic Name: S-phenyl (2S,3S,4R)-2,4-dimethyl-3-oxidanyl-4-phenylsulfanyl-hexanethioate Openeye Name: S-phenyl (2S,3S,4R)-3-hydroxy-2,4-dimethyl-4-phenylsulfanyl-hexanethioate CAS Name: (2S,3S,4R)-3-hydroxy-2,4-dimethyl-4-(phenylthio)hexanethioic acid S-phenyl ester IUPAC Name: S-phenyl (2S,3S,4R)-3-hydroxy-2,4-dimethyl-4-phenylsulfanylhexanethioate Traditional Name: (2S,3S,4R)-3-hydroxy-2,4-dimethyl-4-(phenylthio)hexanethioic acid S-phenyl ester Formula: C20H24O2S2 MolecularWeight: 360.53336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C(C(C)C(=O)SC1=CC=CC=C1)O)SC2=CC=CC=C2

Isomeric SMILES

CC[C@](C)([C@H]([C@H](C)C(=O)SC1=CC=CC=C1)O)SC2=CC=CC=C2

InChI

InChI=1S/C20H24O2S2/c1-4-20(3,24-17-13-9-6-10-14-17)18(21)15(2)19(22)23-16-11-7-5-8-12-16/h5-15,18,21H,4H2,1-3H3/t15-,18-,20+/m0/s1