S-(phenylmethyl) 2-(2,2-dimethylpropoxysulfonyl)ethanethioate

Systemtic Name: S-(phenylmethyl) 2-(2,2-dimethylpropoxysulfonyl)ethanethioate Openeye Name: S-benzyl 2-(2,2-dimethylpropoxysulfonyl)ethanethioate CAS Name: 2-(2,2-dimethylpropoxysulfonyl)ethanethioic acid S-(phenylmethyl) ester IUPAC Name: S-benzyl 2-(2,2-dimethylpropoxysulfonyl)ethanethioate Traditional Name: 2-neopentyloxysulfonylethanethioic acid S-benzyl ester Formula: C14H20O4S2 MolecularWeight: 316.4362

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)COS(=O)(=O)CC(=O)SCC1=CC=CC=C1

Isomeric SMILES

CC(C)(C)COS(=O)(=O)CC(=O)SCC1=CC=CC=C1

InChI

InChI=1S/C14H20O4S2/c1-14(2,3)11-18-20(16,17)10-13(15)19-9-12-7-5-4-6-8-12/h4-8H,9-11H2,1-3H3