N-[4-bromanyl-1-[(2-fluorophenyl)methyl]pyrazol-3-yl]-2,3,5,6-tetramethyl-benzenesulfonamide

Systemtic Name: N-[4-bromanyl-1-[(2-fluorophenyl)methyl]pyrazol-3-yl]-2,3,5,6-tetramethyl-benzenesulfonamide Openeye Name: N-[4-bromo-1-[(2-fluorophenyl)methyl]pyrazol-3-yl]-2,3,5,6-tetramethyl-benzenesulfonamide CAS Name: N-[4-bromo-1-[(2-fluorophenyl)methyl]-3-pyrazolyl]-2,3,5,6-tetramethylbenzenesulfonamide IUPAC Name: N-[4-bromo-1-[(2-fluorophenyl)methyl]pyrazol-3-yl]-2,3,5,6-tetramethylbenzenesulfonamide Traditional Name: N-[4-bromo-1-(2-fluorobenzyl)pyrazol-3-yl]-2,3,5,6-tetramethyl-benzenesulfonamide Formula: C20H21BrFN3O2S MolecularWeight: 466.367043

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)S(=O)(=O)NC2=NN(C=C2Br)CC3=CC=CC=C3F)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1C)S(=O)(=O)NC2=NN(C=C2Br)CC3=CC=CC=C3F)C)C

InChI

InChI=1S/C20H21BrFN3O2S/c1-12-9-13(2)15(4)19(14(12)3)28(26,27)24-20-17(21)11-25(23-20)10-16-7-5-6-8-18(16)22/h5-9,11H,10H2,1-4H3,(H,23,24)