S-[[4-(ethanoylsulfanylmethyl)phenyl]methyl] ethanethioate

Systemtic Name: S-[[4-(ethanoylsulfanylmethyl)phenyl]methyl] ethanethioate Openeye Name: S-[[4-(acetylsulfanylmethyl)phenyl]methyl] ethanethioate CAS Name: ethanethioic acid S-[[4-[(acetylthio)methyl]phenyl]methyl] ester IUPAC Name: S-[[4-(acetylsulfanylmethyl)phenyl]methyl] ethanethioate Traditional Name: ethanethioic acid S-[4-[(acetylthio)methyl]benzyl] ester Formula: C12H14O2S2 MolecularWeight: 254.36836

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC1=CC=C(C=C1)CSC(=O)C

Isomeric SMILES

CC(=O)SCC1=CC=C(C=C1)CSC(=O)C

InChI

InChI=1S/C12H14O2S2/c1-9(13)15-7-11-3-5-12(6-4-11)8-16-10(2)14/h3-6H,7-8H2,1-2H3