S-tert-butyl (3S)-3-oxidanyl-4-phenyl-butanethioate

Systemtic Name: S-tert-butyl (3S)-3-oxidanyl-4-phenyl-butanethioate Openeye Name: S-tert-butyl (3S)-3-hydroxy-4-phenyl-butanethioate CAS Name: (3S)-3-hydroxy-4-phenylbutanethioic acid S-tert-butyl ester IUPAC Name: S-tert-butyl (3S)-3-hydroxy-4-phenylbutanethioate Traditional Name: (3S)-3-hydroxy-4-phenyl-butanethioic acid S-tert-butyl ester Formula: C14H20O2S MolecularWeight: 252.3724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)SC(=O)CC(CC1=CC=CC=C1)O

Isomeric SMILES

CC(C)(C)SC(=O)C[C@H](CC1=CC=CC=C1)O

InChI

InChI=1S/C14H20O2S/c1-14(2,3)17-13(16)10-12(15)9-11-7-5-4-6-8-11/h4-8,12,15H,9-10H2,1-3H3/t12-/m0/s1