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

Systemtic Name: 2,5-bis(bromanyl)-N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]benzenesulfonamide Openeye Name: 2,5-dibromo-N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]benzenesulfonamide CAS Name: 2,5-dibromo-N-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl]benzenesulfonamide IUPAC Name: 2,5-dibromo-N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]benzenesulfonamide Traditional Name: 2,5-dibromo-N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]benzenesulfonamide Formula: C18H17Br2N3O2S MolecularWeight: 499.21948

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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)Br

Isomeric SMILES

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

InChI

InChI=1S/C18H17Br2N3O2S/c1-12-16(13(2)23(22-12)15-6-4-3-5-7-15)11-21-26(24,25)18-10-14(19)8-9-17(18)20/h3-10,21H,11H2,1-2H3