N-(3-ethanoylphenyl)-4-methylsulfanyl-3-morpholin-4-ylcarbonyl-benzenesulfonamide

Systemtic Name: N-(3-ethanoylphenyl)-4-methylsulfanyl-3-morpholin-4-ylcarbonyl-benzenesulfonamide Openeye Name: N-(3-acetylphenyl)-4-methylsulfanyl-3-(morpholine-4-carbonyl)benzenesulfonamide CAS Name: N-(3-acetylphenyl)-4-(methylthio)-3-[4-morpholinyl(oxo)methyl]benzenesulfonamide IUPAC Name: N-(3-acetylphenyl)-4-methylsulfanyl-3-(morpholine-4-carbonyl)benzenesulfonamide Traditional Name: N-(3-acetylphenyl)-4-(methylthio)-3-(morpholine-4-carbonyl)benzenesulfonamide Formula: C20H22N2O5S2 MolecularWeight: 434.52908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NS(=O)(=O)C2=CC(=C(C=C2)SC)C(=O)N3CCOCC3

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NS(=O)(=O)C2=CC(=C(C=C2)SC)C(=O)N3CCOCC3

InChI

InChI=1S/C20H22N2O5S2/c1-14(23)15-4-3-5-16(12-15)21-29(25,26)17-6-7-19(28-2)18(13-17)20(24)22-8-10-27-11-9-22/h3-7,12-13,21H,8-11H2,1-2H3