S-(phenylmethyl) (2S,3R)-2-ethyl-5-phenylmethoxy-3-phenylsulfanyl-pentanethioate

Systemtic Name: S-(phenylmethyl) (2S,3R)-2-ethyl-5-phenylmethoxy-3-phenylsulfanyl-pentanethioate Openeye Name: S-benzyl (2S,3R)-5-benzyloxy-2-ethyl-3-phenylsulfanyl-pentanethioate CAS Name: (2S,3R)-2-ethyl-5-phenylmethoxy-3-(phenylthio)pentanethioic acid S-(phenylmethyl) ester IUPAC Name: S-benzyl (2S,3R)-2-ethyl-5-phenylmethoxy-3-phenylsulfanylpentanethioate Traditional Name: (2S,3R)-5-benzoxy-2-ethyl-3-(phenylthio)pentanethioic acid S-benzyl ester Formula: C27H30O2S2 MolecularWeight: 450.6559

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(CCOCC1=CC=CC=C1)SC2=CC=CC=C2)C(=O)SCC3=CC=CC=C3

Isomeric SMILES

CC[C@@H]([C@@H](CCOCC1=CC=CC=C1)SC2=CC=CC=C2)C(=O)SCC3=CC=CC=C3

InChI

InChI=1S/C27H30O2S2/c1-2-25(27(28)30-21-23-14-8-4-9-15-23)26(31-24-16-10-5-11-17-24)18-19-29-20-22-12-6-3-7-13-22/h3-17,25-26H,2,18-21H2,1H3/t25-,26+/m0/s1