1-[(4-bromanyl-2-fluoranyl-phenyl)methyl]-N,N,3,5-tetramethyl-pyrazole-4-sulfonamide

Systemtic Name: 1-[(4-bromanyl-2-fluoranyl-phenyl)methyl]-N,N,3,5-tetramethyl-pyrazole-4-sulfonamide Openeye Name: 1-[(4-bromo-2-fluoro-phenyl)methyl]-N,N,3,5-tetramethyl-pyrazole-4-sulfonamide CAS Name: 1-[(4-bromo-2-fluorophenyl)methyl]-N,N,3,5-tetramethyl-4-pyrazolesulfonamide IUPAC Name: 1-[(4-bromo-2-fluorophenyl)methyl]-N,N,3,5-tetramethylpyrazole-4-sulfonamide Traditional Name: 1-(4-bromo-2-fluoro-benzyl)-N,N,3,5-tetramethyl-pyrazole-4-sulfonamide Formula: C14H17BrFN3O2S MolecularWeight: 390.271083

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=C(C=C(C=C2)Br)F)C)S(=O)(=O)N(C)C

Isomeric SMILES

CC1=C(C(=NN1CC2=C(C=C(C=C2)Br)F)C)S(=O)(=O)N(C)C

InChI

InChI=1S/C14H17BrFN3O2S/c1-9-14(22(20,21)18(3)4)10(2)19(17-9)8-11-5-6-12(15)7-13(11)16/h5-7H,8H2,1-4H3