| SpectraBase Spectrum ID |
1lZqulu3W1A |
| Name |
2-(methylthio)-1-(2-(5-(4-(trifluoromethoxy)phenyl)-1H-imidazol-2-yl)piperidin-1-yl)propan-1-one |
| Appearance |
Pale yellow solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H22F3N3O2S |
| InChI |
InChI=1S/C19H22F3N3O2S/c1-12(28-2)18(26)25-10-4-3-5-16(25)17-23-11-15(24-17)13-6-8-14(9-7-13)27-19(20,21)22/h6-9,11-12,16H,3-5,10H2,1-2H3,(H,23,24) |
| InChIKey |
KROGWFNAYNVOFA-UHFFFAOYSA-N |
| Instrument Name |
GCMS |
| Ionization Type |
EI |
| Molecular Weight |
413.459 g/mol |
| SMILES |
[nH]1c(cnc1C1N(C(C(SC)C)=O)CCCC1)-c1ccc(cc1)OC(F)(F)F |
| SPLASH |
splash10-03di-1019000000-25d912a90e4a7bf0018f |
| Source of Spectrum |
WO2021074281A1 |
| Wiley ID |
1880047 |
