3-bromanyl-N-[[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]methyl]benzenesulfonamide

Systemtic Name: 3-bromanyl-N-[[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]methyl]benzenesulfonamide Openeye Name: N-[(1-benzyl-3,5-dimethyl-pyrazol-4-yl)methyl]-3-bromo-benzenesulfonamide CAS Name: 3-bromo-N-[[3,5-dimethyl-1-(phenylmethyl)-4-pyrazolyl]methyl]benzenesulfonamide IUPAC Name: N-[(1-benzyl-3,5-dimethylpyrazol-4-yl)methyl]-3-bromobenzenesulfonamide Traditional Name: N-[(1-benzyl-3,5-dimethyl-pyrazol-4-yl)methyl]-3-bromo-benzenesulfonamide Formula: C19H20BrN3O2S MolecularWeight: 434.35

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC=C2)C)CNS(=O)(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC=C2)C)CNS(=O)(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C19H20BrN3O2S/c1-14-19(12-21-26(24,25)18-10-6-9-17(20)11-18)15(2)23(22-14)13-16-7-4-3-5-8-16/h3-11,21H,12-13H2,1-2H3