4-[4-(3-chloranyl-4-methylsulfanyl-phenyl)-5-(trifluoromethyl)-1H-pyrazol-3-yl]benzenesulfonamide

Systemtic Name: 4-[4-(3-chloranyl-4-methylsulfanyl-phenyl)-5-(trifluoromethyl)-1H-pyrazol-3-yl]benzenesulfonamide Openeye Name: 4-[4-(3-chloro-4-methylsulfanyl-phenyl)-5-(trifluoromethyl)-1H-pyrazol-3-yl]benzenesulfonamide CAS Name: 4-[4-[3-chloro-4-(methylthio)phenyl]-5-(trifluoromethyl)-1H-pyrazol-3-yl]benzenesulfonamide IUPAC Name: 4-[4-(3-chloro-4-methylsulfanylphenyl)-5-(trifluoromethyl)-1H-pyrazol-3-yl]benzenesulfonamide Traditional Name: 4-[4-[3-chloro-4-(methylthio)phenyl]-5-(trifluoromethyl)-1H-pyrazol-3-yl]benzenesulfonamide Formula: C17H13ClF3N3O2S2 MolecularWeight: 447.88223

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C(C=C1)C2=C(NN=C2C3=CC=C(C=C3)S(=O)(=O)N)C(F)(F)F)Cl

Isomeric SMILES

CSC1=C(C=C(C=C1)C2=C(NN=C2C3=CC=C(C=C3)S(=O)(=O)N)C(F)(F)F)Cl

InChI

InChI=1S/C17H13ClF3N3O2S2/c1-27-13-7-4-10(8-12(13)18)14-15(23-24-16(14)17(19,20)21)9-2-5-11(6-3-9)28(22,25)26/h2-8H,1H3,(H,23,24)(H2,22,25,26)