S-(2,3-dimethyl-4-oxidanylidene-pentan-2-yl) ethanethioate

Systemtic Name: S-(2,3-dimethyl-4-oxidanylidene-pentan-2-yl) ethanethioate Openeye Name: S-(1,1,2-trimethyl-3-oxo-butyl) ethanethioate CAS Name: ethanethioic acid S-(2,3-dimethyl-4-oxopentan-2-yl) ester IUPAC Name: S-(2,3-dimethyl-4-oxopentan-2-yl) ethanethioate Traditional Name: ethanethioic acid S-(3-keto-1,1,2-trimethyl-butyl) ester Formula: C9H16O2S MolecularWeight: 188.28714

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H16O2S/c1-6(7(2)10)9(4,5)12-8(3)11/h6H,1-5H3