S-[2-(ethanoylsulfanylmethyl)-3-phenyl-propyl] ethanethioate

Systemtic Name: S-[2-(ethanoylsulfanylmethyl)-3-phenyl-propyl] ethanethioate Openeye Name: S-[2-(acetylsulfanylmethyl)-3-phenyl-propyl] ethanethioate CAS Name: ethanethioic acid S-[2-[(acetylthio)methyl]-3-phenylpropyl] ester IUPAC Name: S-[2-(acetylsulfanylmethyl)-3-phenylpropyl] ethanethioate Traditional Name: ethanethioic acid S-[2-[(acetylthio)methyl]-3-phenyl-propyl] ester Formula: C14H18O2S2 MolecularWeight: 282.42152

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC(CC1=CC=CC=C1)CSC(=O)C

Isomeric SMILES

CC(=O)SCC(CC1=CC=CC=C1)CSC(=O)C

InChI

InChI=1S/C14H18O2S2/c1-11(15)17-9-14(10-18-12(2)16)8-13-6-4-3-5-7-13/h3-7,14H,8-10H2,1-2H3