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

Systemtic Name: 4-[5-[bis(fluoranyl)methyl]-4-(4-bromophenyl)-2-phenyl-pyrazol-3-yl]benzenesulfonamide Openeye Name: 4-[4-(4-bromophenyl)-5-(difluoromethyl)-2-phenyl-pyrazol-3-yl]benzenesulfonamide CAS Name: 4-[4-(4-bromophenyl)-5-(difluoromethyl)-2-phenyl-3-pyrazolyl]benzenesulfonamide IUPAC Name: 4-[4-(4-bromophenyl)-5-(difluoromethyl)-2-phenylpyrazol-3-yl]benzenesulfonamide Traditional Name: 4-[4-(4-bromophenyl)-5-(difluoromethyl)-2-phenyl-pyrazol-3-yl]benzenesulfonamide Formula: C22H16BrF2N3O2S MolecularWeight: 504.347146

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=C(C(=N2)C(F)F)C3=CC=C(C=C3)Br)C4=CC=C(C=C4)S(=O)(=O)N

Isomeric SMILES

C1=CC=C(C=C1)N2C(=C(C(=N2)C(F)F)C3=CC=C(C=C3)Br)C4=CC=C(C=C4)S(=O)(=O)N

InChI

InChI=1S/C22H16BrF2N3O2S/c23-16-10-6-14(7-11-16)19-20(22(24)25)27-28(17-4-2-1-3-5-17)21(19)15-8-12-18(13-9-15)31(26,29)30/h1-13,22H,(H2,26,29,30)