tert-butyl 4-(ethanoylsulfanylmethyl)thiolane-3-carboxylate

Systemtic Name: tert-butyl 4-(ethanoylsulfanylmethyl)thiolane-3-carboxylate Openeye Name: tert-butyl 4-(acetylsulfanylmethyl)tetrahydrothiophene-3-carboxylate CAS Name: 4-[(acetylthio)methyl]-3-thiolanecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(acetylsulfanylmethyl)thiolane-3-carboxylate Traditional Name: 4-[(acetylthio)methyl]tetrahydrothiophene-3-carboxylic acid tert-butyl ester Formula: C12H20O3S2 MolecularWeight: 276.4154

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC1CSCC1C(=O)OC(C)(C)C

Isomeric SMILES

CC(=O)SCC1CSCC1C(=O)OC(C)(C)C

InChI

InChI=1S/C12H20O3S2/c1-8(13)17-6-9-5-16-7-10(9)11(14)15-12(2,3)4/h9-10H,5-7H2,1-4H3