1-(3,5-diethanoyl-4-sulfanyl-phenyl)ethanone

Systemtic Name: 1-(3,5-diethanoyl-4-sulfanyl-phenyl)ethanone Openeye Name: 1-(3,5-diacetyl-4-sulfanyl-phenyl)ethanone CAS Name: 1-(3,5-diacetyl-4-mercaptophenyl)ethanone IUPAC Name: 1-(3,5-diacetyl-4-sulfanylphenyl)ethanone Traditional Name: 1-(3,5-diacetyl-4-mercapto-phenyl)ethanone Formula: C12H12O3S MolecularWeight: 236.28688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C(=C1)C(=O)C)S)C(=O)C

Isomeric SMILES

CC(=O)C1=CC(=C(C(=C1)C(=O)C)S)C(=O)C

InChI

InChI=1S/C12H12O3S/c1-6(13)9-4-10(7(2)14)12(16)11(5-9)8(3)15/h4-5,16H,1-3H3