S-tert-butyl (3S,4S)-3-oxidanyl-4-phenylmethoxy-pentanethioate

Systemtic Name: S-tert-butyl (3S,4S)-3-oxidanyl-4-phenylmethoxy-pentanethioate Openeye Name: S-tert-butyl (3S,4S)-4-benzyloxy-3-hydroxy-pentanethioate CAS Name: (3S,4S)-3-hydroxy-4-phenylmethoxypentanethioic acid S-tert-butyl ester IUPAC Name: S-tert-butyl (3S,4S)-3-hydroxy-4-phenylmethoxypentanethioate Traditional Name: (3S,4S)-4-benzoxy-3-hydroxy-pentanethioic acid S-tert-butyl ester Formula: C16H24O3S MolecularWeight: 296.42496

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(CC(=O)SC(C)(C)C)O)OCC1=CC=CC=C1

Isomeric SMILES

C[C@@H]([C@H](CC(=O)SC(C)(C)C)O)OCC1=CC=CC=C1

InChI

InChI=1S/C16H24O3S/c1-12(19-11-13-8-6-5-7-9-13)14(17)10-15(18)20-16(2,3)4/h5-9,12,14,17H,10-11H2,1-4H3/t12-,14-/m0/s1