S-(4-phenylsulfanylbutyl) ethanethioate

Systemtic Name: S-(4-phenylsulfanylbutyl) ethanethioate Openeye Name: S-(4-phenylsulfanylbutyl) ethanethioate CAS Name: ethanethioic acid S-[4-(phenylthio)butyl] ester IUPAC Name: S-(4-phenylsulfanylbutyl) ethanethioate Traditional Name: ethanethioic acid S-[4-(phenylthio)butyl] ester Formula: C12H16OS2 MolecularWeight: 240.38484

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCCCCSC1=CC=CC=C1

Isomeric SMILES

CC(=O)SCCCCSC1=CC=CC=C1

InChI

InChI=1S/C12H16OS2/c1-11(13)14-9-5-6-10-15-12-7-3-2-4-8-12/h2-4,7-8H,5-6,9-10H2,1H3