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

Systemtic Name: 4-bromanyl-N-[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]benzenesulfonamide Openeye Name: N-(1-benzyl-3,5-dimethyl-pyrazol-4-yl)-4-bromo-benzenesulfonamide CAS Name: 4-bromo-N-[3,5-dimethyl-1-(phenylmethyl)-4-pyrazolyl]benzenesulfonamide IUPAC Name: N-(1-benzyl-3,5-dimethylpyrazol-4-yl)-4-bromobenzenesulfonamide Traditional Name: N-(1-benzyl-3,5-dimethyl-pyrazol-4-yl)-4-bromo-benzenesulfonamide Formula: C18H18BrN3O2S MolecularWeight: 420.32342

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18BrN3O2S/c1-13-18(21-25(23,24)17-10-8-16(19)9-11-17)14(2)22(20-13)12-15-6-4-3-5-7-15/h3-11,21H,12H2,1-2H3