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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CNS(=O)(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CNS(=O)(=O)C3=CC(=CC=C3)Br

InChI

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