3-(4-methylsulfanylphenyl)-6-(phenylmethyl)-2-(1H-pyrazol-5-yl)-4-(trifluoromethyl)benzenesulfonamide

Systemtic Name: 3-(4-methylsulfanylphenyl)-6-(phenylmethyl)-2-(1H-pyrazol-5-yl)-4-(trifluoromethyl)benzenesulfonamide Openeye Name: 6-benzyl-3-(4-methylsulfanylphenyl)-2-(1H-pyrazol-5-yl)-4-(trifluoromethyl)benzenesulfonamide CAS Name: 3-[4-(methylthio)phenyl]-6-(phenylmethyl)-2-(1H-pyrazol-5-yl)-4-(trifluoromethyl)benzenesulfonamide IUPAC Name: 6-benzyl-3-(4-methylsulfanylphenyl)-2-(1H-pyrazol-5-yl)-4-(trifluoromethyl)benzenesulfonamide Traditional Name: 6-benzyl-3-[4-(methylthio)phenyl]-2-(1H-pyrazol-5-yl)-4-(trifluoromethyl)benzenesulfonamide Formula: C24H20F3N3O2S2 MolecularWeight: 503.55971

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C2=C(C(=C(C=C2C(F)(F)F)CC3=CC=CC=C3)S(=O)(=O)N)C4=CC=NN4

Isomeric SMILES

CSC1=CC=C(C=C1)C2=C(C(=C(C=C2C(F)(F)F)CC3=CC=CC=C3)S(=O)(=O)N)C4=CC=NN4

InChI

InChI=1S/C24H20F3N3O2S2/c1-33-18-9-7-16(8-10-18)21-19(24(25,26)27)14-17(13-15-5-3-2-4-6-15)23(34(28,31)32)22(21)20-11-12-29-30-20/h2-12,14H,13H2,1H3,(H,29,30)(H2,28,31,32)