5-bromanyl-N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-2-methoxy-benzenesulfonamide

Systemtic Name: 5-bromanyl-N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-2-methoxy-benzenesulfonamide Openeye Name: 5-bromo-N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-2-methoxy-benzenesulfonamide CAS Name: 5-bromo-N-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl]-2-methoxybenzenesulfonamide IUPAC Name: 5-bromo-N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]-2-methoxybenzenesulfonamide Traditional Name: 5-bromo-N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-2-methoxy-benzenesulfonamide Formula: C19H20BrN3O3S MolecularWeight: 450.3494

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20BrN3O3S/c1-13-17(14(2)23(22-13)16-7-5-4-6-8-16)12-21-27(24,25)19-11-15(20)9-10-18(19)26-3/h4-11,21H,12H2,1-3H3