S-[2,4,6-tri(propan-2-yl)phenyl] (2S,3R)-2,4-dimethyl-3-oxidanyl-pentanethioate

Systemtic Name: S-[2,4,6-tri(propan-2-yl)phenyl] (2S,3R)-2,4-dimethyl-3-oxidanyl-pentanethioate Openeye Name: S-(2,4,6-triisopropylphenyl) (2S,3R)-3-hydroxy-2,4-dimethyl-pentanethioate CAS Name: (2S,3R)-3-hydroxy-2,4-dimethylpentanethioic acid S-[2,4,6-tri(propan-2-yl)phenyl] ester IUPAC Name: S-[2,4,6-tri(propan-2-yl)phenyl] (2S,3R)-3-hydroxy-2,4-dimethylpentanethioate Traditional Name: (2S,3R)-3-hydroxy-2,4-dimethyl-pentanethioic acid S-(2,4,6-triisopropylphenyl) ester Formula: C22H36O2S MolecularWeight: 364.58504

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@@H]([C@@H](C(C)C)O)C(=O)SC1=C(C=C(C=C1C(C)C)C(C)C)C(C)C

InChI

InChI=1S/C22H36O2S/c1-12(2)17-10-18(13(3)4)21(19(11-17)14(5)6)25-22(24)16(9)20(23)15(7)8/h10-16,20,23H,1-9H3/t16-,20+/m0/s1