3-(2-dimethylaminoethyl)-4-(4-methylsulfanylphenyl)-2-(1H-pyrazol-5-yl)-5-(trifluoromethyl)benzenesulfonamide

Systemtic Name: 3-(2-dimethylaminoethyl)-4-(4-methylsulfanylphenyl)-2-(1H-pyrazol-5-yl)-5-(trifluoromethyl)benzenesulfonamide Openeye Name: 3-(2-dimethylaminoethyl)-4-(4-methylsulfanylphenyl)-2-(1H-pyrazol-5-yl)-5-(trifluoromethyl)benzenesulfonamide CAS Name: 3-(2-dimethylaminoethyl)-4-[4-(methylthio)phenyl]-2-(1H-pyrazol-5-yl)-5-(trifluoromethyl)benzenesulfonamide IUPAC Name: 3-(2-dimethylaminoethyl)-4-(4-methylsulfanylphenyl)-2-(1H-pyrazol-5-yl)-5-(trifluoromethyl)benzenesulfonamide Traditional Name: 3-(2-dimethylaminoethyl)-4-[4-(methylthio)phenyl]-2-(1H-pyrazol-5-yl)-5-(trifluoromethyl)benzenesulfonamide Formula: C21H23F3N4O2S2 MolecularWeight: 484.55813

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCC1=C(C(=CC(=C1C2=CC=NN2)S(=O)(=O)N)C(F)(F)F)C3=CC=C(C=C3)SC

Isomeric SMILES

CN(C)CCC1=C(C(=CC(=C1C2=CC=NN2)S(=O)(=O)N)C(F)(F)F)C3=CC=C(C=C3)SC

InChI

InChI=1S/C21H23F3N4O2S2/c1-28(2)11-9-15-19(13-4-6-14(31-3)7-5-13)16(21(22,23)24)12-18(32(25,29)30)20(15)17-8-10-26-27-17/h4-8,10,12H,9,11H2,1-3H3,(H,26,27)(H2,25,29,30)