S-(3-ethynylphenyl) ethanethioate

Systemtic Name: S-(3-ethynylphenyl) ethanethioate Openeye Name: S-(3-ethynylphenyl) ethanethioate CAS Name: ethanethioic acid S-(3-ethynylphenyl) ester IUPAC Name: S-(3-ethynylphenyl) ethanethioate Traditional Name: ethanethioic acid S-(3-ethynylphenyl) ester Formula: C10H8OS MolecularWeight: 176.23492

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC1=CC=CC(=C1)C#C

Isomeric SMILES

CC(=O)SC1=CC=CC(=C1)C#C

InChI

InChI=1S/C10H8OS/c1-3-9-5-4-6-10(7-9)12-8(2)11/h1,4-7H,2H3