(phenylmethyl) 5-(ethanoylsulfanylmethyl)thiolane-3-carboxylate

Systemtic Name: (phenylmethyl) 5-(ethanoylsulfanylmethyl)thiolane-3-carboxylate Openeye Name: benzyl 5-(acetylsulfanylmethyl)tetrahydrothiophene-3-carboxylate CAS Name: 5-[(acetylthio)methyl]-3-thiolanecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 5-(acetylsulfanylmethyl)thiolane-3-carboxylate Traditional Name: 5-[(acetylthio)methyl]tetrahydrothiophene-3-carboxylic acid benzyl ester Formula: C15H18O3S2 MolecularWeight: 310.43162

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC1CC(CS1)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(=O)SCC1CC(CS1)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C15H18O3S2/c1-11(16)19-10-14-7-13(9-20-14)15(17)18-8-12-5-3-2-4-6-12/h2-6,13-14H,7-10H2,1H3