4-[5-(4-iodanylphenyl)-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide

Systemtic Name: 4-[5-(4-iodanylphenyl)-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide Openeye Name: 4-[5-(4-iodanylphenyl)-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide CAS Name: 4-[5-(4-iodanylphenyl)-3-(trifluoromethyl)-1-pyrazolyl]benzenesulfonamide IUPAC Name: 4-[5-(4-iodanylphenyl)-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide Traditional Name: 4-[5-(4-iodanylphenyl)-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide Formula: C16H11F3IN3O2S MolecularWeight: 489.243248

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC(=NN2C3=CC=C(C=C3)S(=O)(=O)N)C(F)(F)F)I

Isomeric SMILES

C1=CC(=CC=C1C2=CC(=NN2C3=CC=C(C=C3)S(=O)(=O)N)C(F)(F)F)[123I]

InChI

InChI=1S/C16H11F3IN3O2S/c17-16(18,19)15-9-14(10-1-3-11(20)4-2-10)23(22-15)12-5-7-13(8-6-12)26(21,24)25/h1-9H,(H2,21,24,25)/i20-4