N-(4-bromanyl-2-fluoranyl-phenyl)-4-methyl-N-(4-methylphenyl)sulfonyl-benzenesulfonamide

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-4-methyl-N-(4-methylphenyl)sulfonyl-benzenesulfonamide Openeye Name: N-(4-bromo-2-fluoro-phenyl)-4-methyl-N-(p-tolylsulfonyl)benzenesulfonamide CAS Name: N-(4-bromo-2-fluorophenyl)-4-methyl-N-(4-methylphenyl)sulfonylbenzenesulfonamide IUPAC Name: N-(4-bromo-2-fluorophenyl)-4-methyl-N-(4-methylphenyl)sulfonylbenzenesulfonamide Traditional Name: N-(4-bromo-2-fluoro-phenyl)-4-methyl-N-tosyl-benzenesulfonamide Formula: C20H17BrFNO4S2 MolecularWeight: 498.385683

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H17BrFNO4S2/c1-14-3-8-17(9-4-14)28(24,25)23(20-12-7-16(21)13-19(20)22)29(26,27)18-10-5-15(2)6-11-18/h3-13H,1-2H3