5-(dimethylaminomethyl)-2-methylsulfanyl-4-[4-(trifluoromethyloxy)phenoxy]benzenesulfonamide

Systemtic Name: 5-(dimethylaminomethyl)-2-methylsulfanyl-4-[4-(trifluoromethyloxy)phenoxy]benzenesulfonamide Openeye Name: 5-(dimethylaminomethyl)-2-methylsulfanyl-4-[4-(trifluoromethoxy)phenoxy]benzenesulfonamide CAS Name: 5-(dimethylaminomethyl)-2-(methylthio)-4-[4-(trifluoromethoxy)phenoxy]benzenesulfonamide IUPAC Name: 5-(dimethylaminomethyl)-2-methylsulfanyl-4-[4-(trifluoromethoxy)phenoxy]benzenesulfonamide Traditional Name: 5-(dimethylaminomethyl)-2-(methylthio)-4-[4-(trifluoromethoxy)phenoxy]benzenesulfonamide Formula: C17H19F3N2O4S2 MolecularWeight: 436.46897

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CC(=C(C=C1OC2=CC=C(C=C2)OC(F)(F)F)SC)S(=O)(=O)N

Isomeric SMILES

CN(C)CC1=CC(=C(C=C1OC2=CC=C(C=C2)OC(F)(F)F)SC)S(=O)(=O)N

InChI

InChI=1S/C17H19F3N2O4S2/c1-22(2)10-11-8-16(28(21,23)24)15(27-3)9-14(11)25-12-4-6-13(7-5-12)26-17(18,19)20/h4-9H,10H2,1-3H3,(H2,21,23,24)