4-bromanyl-3-methyl-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]benzenesulfonamide

Systemtic Name: 4-bromanyl-3-methyl-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]benzenesulfonamide Openeye Name: 4-bromo-3-methyl-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]benzenesulfonamide CAS Name: 4-bromo-3-methyl-N-[[2-(1-pyrazolylmethyl)phenyl]methyl]benzenesulfonamide IUPAC Name: 4-bromo-3-methyl-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]benzenesulfonamide Traditional Name: 4-bromo-3-methyl-N-[2-(pyrazol-1-ylmethyl)benzyl]benzenesulfonamide Formula: C18H18BrN3O2S MolecularWeight: 420.32342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)NCC2=CC=CC=C2CN3C=CC=N3)Br

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)NCC2=CC=CC=C2CN3C=CC=N3)Br

InChI

InChI=1S/C18H18BrN3O2S/c1-14-11-17(7-8-18(14)19)25(23,24)21-12-15-5-2-3-6-16(15)13-22-10-4-9-20-22/h2-11,21H,12-13H2,1H3