| SpectraBase Spectrum ID |
62mYNgRG6dY |
| Name |
Celecoxib |
| Alternate Name(s) |
Celebrex
4-(5-(p-tolyl)-3-(trifluoromethyl)-1H-pyrazol-1-yl)benzenesulfonamide |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H14F3N3O2S |
| InChI |
InChI=1S/C17H14F3N3O2S/c1-11-2-4-12(5-3-11)15-10-16(17(18,19)20)22-23(15)13-6-8-14(9-7-13)26(21,24)25/h2-10H,1H3,(H2,21,24,25) |
| InChIKey |
RZEKVGVHFLEQIL-UHFFFAOYSA-N |
| Molecular Weight |
381.373 g/mol |
| SMILES |
NS(c1ccc(-[n]2c(-c3ccc(C)cc3)cc(n2)C(F)(F)F)cc1)(=O)=O |
| SPLASH |
splash10-001i-1239000000-238bce833c2d83866734 |
| Source of Spectrum |
SWG-33-2774-0 |
| Wiley ID |
1809804 |
