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

Systemtic Name: 5-(methylaminomethyl)-2-methylsulfanyl-4-[4-(trifluoromethyloxy)phenoxy]benzenesulfonamide Openeye Name: 5-(methylaminomethyl)-2-methylsulfanyl-4-[4-(trifluoromethoxy)phenoxy]benzenesulfonamide CAS Name: 5-(methylaminomethyl)-2-(methylthio)-4-[4-(trifluoromethoxy)phenoxy]benzenesulfonamide IUPAC Name: 5-(methylaminomethyl)-2-methylsulfanyl-4-[4-(trifluoromethoxy)phenoxy]benzenesulfonamide Traditional Name: 5-(methylaminomethyl)-2-(methylthio)-4-[4-(trifluoromethoxy)phenoxy]benzenesulfonamide Formula: C16H17F3N2O4S2 MolecularWeight: 422.44239

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Descriptors Computed from Structure

Canonical SMILES:

CNCC1=CC(=C(C=C1OC2=CC=C(C=C2)OC(F)(F)F)SC)S(=O)(=O)N

Isomeric SMILES

CNCC1=CC(=C(C=C1OC2=CC=C(C=C2)OC(F)(F)F)SC)S(=O)(=O)N

InChI

InChI=1S/C16H17F3N2O4S2/c1-21-9-10-7-15(27(20,22)23)14(26-2)8-13(10)24-11-3-5-12(6-4-11)25-16(17,18)19/h3-8,21H,9H2,1-2H3,(H2,20,22,23)