N-(2,6-dimethylphenyl)-4-methylsulfanyl-3-morpholin-4-ylcarbonyl-benzenesulfonamide

Systemtic Name: N-(2,6-dimethylphenyl)-4-methylsulfanyl-3-morpholin-4-ylcarbonyl-benzenesulfonamide Openeye Name: N-(2,6-dimethylphenyl)-4-methylsulfanyl-3-(morpholine-4-carbonyl)benzenesulfonamide CAS Name: N-(2,6-dimethylphenyl)-4-(methylthio)-3-[4-morpholinyl(oxo)methyl]benzenesulfonamide IUPAC Name: N-(2,6-dimethylphenyl)-4-methylsulfanyl-3-(morpholine-4-carbonyl)benzenesulfonamide Traditional Name: N-(2,6-dimethylphenyl)-4-(methylthio)-3-(morpholine-4-carbonyl)benzenesulfonamide Formula: C20H24N2O4S2 MolecularWeight: 420.54556

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NS(=O)(=O)C2=CC(=C(C=C2)SC)C(=O)N3CCOCC3

Isomeric SMILES

CC1=C(C(=CC=C1)C)NS(=O)(=O)C2=CC(=C(C=C2)SC)C(=O)N3CCOCC3

InChI

InChI=1S/C20H24N2O4S2/c1-14-5-4-6-15(2)19(14)21-28(24,25)16-7-8-18(27-3)17(13-16)20(23)22-9-11-26-12-10-22/h4-8,13,21H,9-12H2,1-3H3