ethyl 5-[(phenylmethylsulfanyl)methyl]thiolane-3-carboxylate

Systemtic Name: ethyl 5-[(phenylmethylsulfanyl)methyl]thiolane-3-carboxylate Openeye Name: ethyl 5-(benzylsulfanylmethyl)tetrahydrothiophene-3-carboxylate CAS Name: 5-[(phenylmethylthio)methyl]-3-thiolanecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(benzylsulfanylmethyl)thiolane-3-carboxylate Traditional Name: 5-[(benzylthio)methyl]tetrahydrothiophene-3-carboxylic acid ethyl ester Formula: C15H20O2S2 MolecularWeight: 296.4481

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC(SC1)CSCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1CC(SC1)CSCC2=CC=CC=C2

InChI

InChI=1S/C15H20O2S2/c1-2-17-15(16)13-8-14(19-10-13)11-18-9-12-6-4-3-5-7-12/h3-7,13-14H,2,8-11H2,1H3