N-[5-(3-fluoranyl-4-methylsulfanyl-phenyl)-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide

Systemtic Name: N-[5-(3-fluoranyl-4-methylsulfanyl-phenyl)-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide Openeye Name: N-[5-(3-fluoro-4-methylsulfanyl-phenyl)-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide CAS Name: N-[5-[3-fluoro-4-(methylthio)phenyl]-3-(trifluoromethyl)-1-pyrazolyl]benzenesulfonamide IUPAC Name: N-[5-(3-fluoro-4-methylsulfanylphenyl)-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide Traditional Name: N-[5-[3-fluoro-4-(methylthio)phenyl]-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide Formula: C17H13F4N3O2S2 MolecularWeight: 431.427633

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C(C=C1)C2=CC(=NN2NS(=O)(=O)C3=CC=CC=C3)C(F)(F)F)F

Isomeric SMILES

CSC1=C(C=C(C=C1)C2=CC(=NN2NS(=O)(=O)C3=CC=CC=C3)C(F)(F)F)F

InChI

InChI=1S/C17H13F4N3O2S2/c1-27-15-8-7-11(9-13(15)18)14-10-16(17(19,20)21)22-24(14)23-28(25,26)12-5-3-2-4-6-12/h2-10,23H,1H3