4-[5-[2,4-bis(fluoranyl)phenyl]-4,4,5-tris(fluoranyl)-3-methyl-pyrazol-1-yl]benzenesulfonamide

Systemtic Name: 4-[5-[2,4-bis(fluoranyl)phenyl]-4,4,5-tris(fluoranyl)-3-methyl-pyrazol-1-yl]benzenesulfonamide Openeye Name: 4-[5-(2,4-difluorophenyl)-4,4,5-trifluoro-3-methyl-pyrazol-1-yl]benzenesulfonamide CAS Name: 4-[5-(2,4-difluorophenyl)-4,4,5-trifluoro-3-methyl-1-pyrazolyl]benzenesulfonamide IUPAC Name: 4-[5-(2,4-difluorophenyl)-4,4,5-trifluoro-3-methylpyrazol-1-yl]benzenesulfonamide Traditional Name: 4-[5-(2,4-difluorophenyl)-4,4,5-trifluoro-3-methyl-2-pyrazolin-1-yl]benzenesulfonamide Formula: C16H12F5N3O2S MolecularWeight: 405.342396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(C1(F)F)(C2=C(C=C(C=C2)F)F)F)C3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

CC1=NN(C(C1(F)F)(C2=C(C=C(C=C2)F)F)F)C3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C16H12F5N3O2S/c1-9-15(19,20)16(21,13-7-2-10(17)8-14(13)18)24(23-9)11-3-5-12(6-4-11)27(22,25)26/h2-8H,1H3,(H2,22,25,26)