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

Systemtic Name: S-phenyl (2S,3S,4R)-2-methyl-3-oxidanyl-4-phenylsulfanyl-hexanethioate Openeye Name: S-phenyl (2S,3S,4R)-3-hydroxy-2-methyl-4-phenylsulfanyl-hexanethioate CAS Name: (2S,3S,4R)-3-hydroxy-2-methyl-4-(phenylthio)hexanethioic acid S-phenyl ester IUPAC Name: S-phenyl (2S,3S,4R)-3-hydroxy-2-methyl-4-phenylsulfanylhexanethioate Traditional Name: (2S,3S,4R)-3-hydroxy-2-methyl-4-(phenylthio)hexanethioic acid S-phenyl ester Formula: C19H22O2S2 MolecularWeight: 346.50678

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22O2S2/c1-3-17(22-15-10-6-4-7-11-15)18(20)14(2)19(21)23-16-12-8-5-9-13-16/h4-14,17-18,20H,3H2,1-2H3/t14-,17+,18-/m0/s1