tert-butyl 5-(sulfanylmethyl)thiolane-3-carboxylate

Systemtic Name: tert-butyl 5-(sulfanylmethyl)thiolane-3-carboxylate Openeye Name: tert-butyl 5-(sulfanylmethyl)tetrahydrothiophene-3-carboxylate CAS Name: 5-(mercaptomethyl)-3-thiolanecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 5-(sulfanylmethyl)thiolane-3-carboxylate Traditional Name: 5-(mercaptomethyl)tetrahydrothiophene-3-carboxylic acid tert-butyl ester Formula: C10H18O2S2 MolecularWeight: 234.37872

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1CC(SC1)CS

Isomeric SMILES

CC(C)(C)OC(=O)C1CC(SC1)CS

InChI

InChI=1S/C10H18O2S2/c1-10(2,3)12-9(11)7-4-8(5-13)14-6-7/h7-8,13H,4-6H2,1-3H3