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

Systemtic Name: 3-[bis(fluoranyl)methyl]-5-(3-bromanyl-4-methoxy-phenyl)-2-pyrazol-1-yl-benzenesulfonamide Openeye Name: 5-(3-bromo-4-methoxy-phenyl)-3-(difluoromethyl)-2-pyrazol-1-yl-benzenesulfonamide CAS Name: 5-(3-bromo-4-methoxyphenyl)-3-(difluoromethyl)-2-(1-pyrazolyl)benzenesulfonamide IUPAC Name: 5-(3-bromo-4-methoxyphenyl)-3-(difluoromethyl)-2-pyrazol-1-ylbenzenesulfonamide Traditional Name: 5-(3-bromo-4-methoxy-phenyl)-3-(difluoromethyl)-2-pyrazol-1-yl-benzenesulfonamide Formula: C17H14BrF2N3O3S MolecularWeight: 458.277166

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CC(=C(C(=C2)S(=O)(=O)N)N3C=CC=N3)C(F)F)Br

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CC(=C(C(=C2)S(=O)(=O)N)N3C=CC=N3)C(F)F)Br

InChI

InChI=1S/C17H14BrF2N3O3S/c1-26-14-4-3-10(8-13(14)18)11-7-12(17(19)20)16(23-6-2-5-22-23)15(9-11)27(21,24)25/h2-9,17H,1H3,(H2,21,24,25)