| SpectraBase Spectrum ID |
40XSRsMmrbd |
| Name |
Phenyl 4-[1-phenyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]phenylsulfamate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
459.086447047 u |
| Formula |
C22H16F3N3O3S |
| InChI |
InChI=1S/C22H16F3N3O3S/c23-22(24,25)21-15-20(28(26-21)18-7-3-1-4-8-18)16-11-13-17(14-12-16)27-32(29,30)31-19-9-5-2-6-10-19/h1-15,27H |
| InChIKey |
KWTNGJZGDQYYKH-UHFFFAOYSA-N |
| Molecular Weight |
459.443 g/mol |
| SMILES |
C1(C=2N(N=C(C2)C(F)(F)F)C2=CC=CC=C2)=CC=C(NS(=O)(OC2=CC=CC=C2)=O)C=C1 |
![Phenyl 4-[1-phenyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]phenylsulfamate](/api/spectrum/40XSRsMmrbd/structure.png?h=300&w=458 "Phenyl 4-[1-phenyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]phenylsulfamate")
