tert-butyl 5-(2-ethanoylsulfanylethyl)thiolane-3-carboxylate

Systemtic Name: tert-butyl 5-(2-ethanoylsulfanylethyl)thiolane-3-carboxylate Openeye Name: tert-butyl 5-(2-acetylsulfanylethyl)tetrahydrothiophene-3-carboxylate CAS Name: 5-[2-(acetylthio)ethyl]-3-thiolanecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 5-(2-acetylsulfanylethyl)thiolane-3-carboxylate Traditional Name: 5-[2-(acetylthio)ethyl]tetrahydrothiophene-3-carboxylic acid tert-butyl ester Formula: C13H22O3S2 MolecularWeight: 290.44198

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCCC1CC(CS1)C(=O)OC(C)(C)C

Isomeric SMILES

CC(=O)SCCC1CC(CS1)C(=O)OC(C)(C)C

InChI

InChI=1S/C13H22O3S2/c1-9(14)17-6-5-11-7-10(8-18-11)12(15)16-13(2,3)4/h10-11H,5-8H2,1-4H3