Products 544686-20-6

CAS 544686-20-6 appears in our catalog under these names: Celecoxib-d4, >95% (HPLC), Celecoxib-d4. Offered by: TRC, Biosynth, MedChemExpress. Available pack sizes: 10mg, 1mg, 5mg, 25mg, 50mg, 1 mg.

Structural formula: {0} (CAS {1})

2,3,5,6-tetradeuterio-4-[5-(4-methylphenyl)-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide (CAS 544686-20-6) is a chemical compound with the molecular formula C17H14F3N3O2S and a molecular weight of 385.4 g/mol. IUPAC name: 2,3,5,6-tetradeuterio-4-[5-(4-methylphenyl)-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide. InChIKey: RZEKVGVHFLEQIL-YKVCKAMESA-N.

Identity
Molecular formulaC17H14F3N3O2S
Molecular weight385.4 g/mol
IUPAC name2,3,5,6-tetradeuterio-4-[5-(4-methylphenyl)-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide
InChIKeyRZEKVGVHFLEQIL-YKVCKAMESA-N
SMILES[2H]C1=C(C(=C(C(=C1N2C(=CC(=N2)C(F)(F)F)C3=CC=C(C=C3)C)[2H])[2H])S(=O)(=O)N)[2H]

Computed by PubChem (NCBI)