S-tert-butyl (3S)-3-methoxy-3-phenyl-propanethioate

Systemtic Name: S-tert-butyl (3S)-3-methoxy-3-phenyl-propanethioate Openeye Name: S-tert-butyl (3S)-3-methoxy-3-phenyl-propanethioate CAS Name: (3S)-3-methoxy-3-phenylpropanethioic acid S-tert-butyl ester IUPAC Name: S-tert-butyl (3S)-3-methoxy-3-phenylpropanethioate Traditional Name: (3S)-3-methoxy-3-phenyl-propanethioic acid S-tert-butyl ester Formula: C14H20O2S MolecularWeight: 252.3724

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20O2S/c1-14(2,3)17-13(15)10-12(16-4)11-8-6-5-7-9-11/h5-9,12H,10H2,1-4H3/t12-/m0/s1