| SpectraBase Spectrum ID |
9Wqv8KnnUBs |
| Name |
2-(methylthio)-1-(2-(5-(4-(trifluoromethyl)phenyl)imidazol-2-yl)piperidin-1-yl)propan-1-one |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H22F3N3OS |
| InChI |
InChI=1S/C19H22F3N3OS/c1-12(27-2)18(26)25-10-4-3-5-16(25)17-23-11-15(24-17)13-6-8-14(9-7-13)19(20,21)22/h6-9,11-12,16H,3-5,10H2,1-2H3,(H,23,24) |
| InChIKey |
VKVZLRMDBDXMJW-UHFFFAOYSA-N |
| Ionization Type |
EI |
| Molecular Weight |
397.460 g/mol |
| SMILES |
[nH]1c(ncc1-c1ccc(cc1)C(F)(F)F)C1N(C(C(C)SC)=O)CCCC1 |
| SPLASH |
splash10-0036-9040000000-7f712a852ad3a73202c3 |
| Source of Spectrum |
WO2021074281A1 |
| Wiley ID |
1880092 |
