1-[5-(dimethylamino)-3-ethanoyl-2-methylsulfanyl-phenyl]ethanone

Systemtic Name: 1-[5-(dimethylamino)-3-ethanoyl-2-methylsulfanyl-phenyl]ethanone Openeye Name: 1-[3-acetyl-5-(dimethylamino)-2-methylsulfanyl-phenyl]ethanone CAS Name: 1-[3-acetyl-5-(dimethylamino)-2-(methylthio)phenyl]ethanone IUPAC Name: 1-[3-acetyl-5-(dimethylamino)-2-methylsulfanylphenyl]ethanone Traditional Name: 1-[3-acetyl-5-(dimethylamino)-2-(methylthio)phenyl]ethanone Formula: C13H17NO2S MolecularWeight: 251.34458

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC(=C1SC)C(=O)C)N(C)C

Isomeric SMILES

CC(=O)C1=CC(=CC(=C1SC)C(=O)C)N(C)C

InChI

InChI=1S/C13H17NO2S/c1-8(15)11-6-10(14(3)4)7-12(9(2)16)13(11)17-5/h6-7H,1-5H3