S-(4-phenylbutyl) ethanethioate

Systemtic Name: S-(4-phenylbutyl) ethanethioate Openeye Name: S-(4-phenylbutyl) ethanethioate CAS Name: ethanethioic acid S-(4-phenylbutyl) ester IUPAC Name: S-(4-phenylbutyl) ethanethioate Traditional Name: ethanethioic acid S-(4-phenylbutyl) ester Formula: C12H16OS MolecularWeight: 208.31984

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCCCCC1=CC=CC=C1

Isomeric SMILES

CC(=O)SCCCCC1=CC=CC=C1

InChI

InChI=1S/C12H16OS/c1-11(13)14-10-6-5-9-12-7-3-2-4-8-12/h2-4,7-8H,5-6,9-10H2,1H3