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

Systemtic Name: methyl (2S,3R,4S)-2-methyl-3-oxidanyl-4-phenyl-pentanedithioate Openeye Name: methyl (2S,3R,4S)-3-hydroxy-2-methyl-4-phenyl-pentanedithioate CAS Name: (2S,3R,4S)-3-hydroxy-2-methyl-4-phenylpentanedithioic acid methyl ester IUPAC Name: methyl (2S,3R,4S)-3-hydroxy-2-methyl-4-phenylpentanedithioate Traditional Name: (2S,3R,4S)-3-hydroxy-2-methyl-4-phenyl-pentanedithioic acid methyl ester Formula: C13H18OS2 MolecularWeight: 254.41142

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)C(C(C)C(=S)SC)O

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)[C@H]([C@H](C)C(=S)SC)O

InChI

InChI=1S/C13H18OS2/c1-9(11-7-5-4-6-8-11)12(14)10(2)13(15)16-3/h4-10,12,14H,1-3H3/t9-,10-,12+/m0/s1