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Celecoxib-d7 (tolyl-d7), CDN
Specifications
Specifications
| Kemisk navn eller materiale | Celecoxib-d7 |
| CAS | 544686-21-7 |
| Molekylær formel | C17 D7 H7 F3 N3 O2 S |
| Mængde | 0.005 g |
| Synonym | Benzenesulfonamide, 4-[5-[4-(methyl-d3)phenyl-2,3,5,6-d4]-3-(trifluoromethyl)-1 H-pyrazol-1-yl]-, 4-[5-[4-(Methyl-d3)phenyl-2,3,5,6-d4]-3-(trifluoromethyl)-1 H-pyrazol-1-yl]benzenesulfonamide, 4-[5-(4-Trideuteromethyl-2,3,5,6-tetradeuterophenyl)-3-(trifluoromethyl)-1 H-pyrazol-1-yl]benzenesulfonamide, Celecoxib-d7, Celecoxib-D7 (tolyl-D7) |
| InChI formel | InChI=1 S/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/h2-10 H,1H3,(H2,21,24,25)/i1D3,2 D,3 D,4 D,5 D |
| SMIL | [2 H]c1c([2 H])c(c([2 H])c([2 H])c1c2cc(nn2c3ccc(cc3)S(=O)(=O)N)C(F)(F)F)C([2 H])([2 H])[2 H] |
| IUPAC navn | 4-[5-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide |
| Molekylvægt (g/mol) | 388.415 |
| Formel vægt | 388.12 g/mol |
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