(4-methyl-4-sulfanyl-pentan-2-yl) ethanoate

Systemtic Name: (4-methyl-4-sulfanyl-pentan-2-yl) ethanoate Openeye Name: (1,3-dimethyl-3-sulfanyl-butyl) acetate CAS Name: acetic acid (4-mercapto-4-methylpentan-2-yl) ester IUPAC Name: (4-methyl-4-sulfanylpentan-2-yl) acetate Traditional Name: acetic acid (3-mercapto-1,3-dimethyl-butyl) ester Formula: C8H16O2S MolecularWeight: 176.27644

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(C)(C)S)OC(=O)C

Isomeric SMILES

CC(CC(C)(C)S)OC(=O)C

InChI

InChI=1S/C8H16O2S/c1-6(10-7(2)9)5-8(3,4)11/h6,11H,5H2,1-4H3