(4-ethanoylphenyl) 2-(2-cyanophenyl)sulfanylbenzoate

Systemtic Name: (4-ethanoylphenyl) 2-(2-cyanophenyl)sulfanylbenzoate Openeye Name: (4-acetylphenyl) 2-(2-cyanophenyl)sulfanylbenzoate CAS Name: 2-[(2-cyanophenyl)thio]benzoic acid (4-acetylphenyl) ester IUPAC Name: (4-acetylphenyl) 2-(2-cyanophenyl)sulfanylbenzoate Traditional Name: 2-[(2-cyanophenyl)thio]benzoic acid (4-acetylphenyl) ester Formula: C22H15NO3S MolecularWeight: 373.4244

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)OC(=O)C2=CC=CC=C2SC3=CC=CC=C3C#N

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)OC(=O)C2=CC=CC=C2SC3=CC=CC=C3C#N

InChI

InChI=1S/C22H15NO3S/c1-15(24)16-10-12-18(13-11-16)26-22(25)19-7-3-5-9-21(19)27-20-8-4-2-6-17(20)14-23/h2-13H,1H3