| SpectraBase Spectrum ID |
FxUomsNOURA |
| Name |
Acetamide, 2-[(4-methyl-4H-1,2,4-triazol-3-yl)thio]-N-[3-(trifluoromethyl)phenyl]- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
316.060566652 u |
| Formula |
C12H11F3N4OS |
| InChI |
InChI=1S/C12H11F3N4OS/c1-19-7-16-18-11(19)21-6-10(20)17-9-4-2-3-8(5-9)12(13,14)15/h2-5,7H,6H2,1H3,(H,17,20) |
| InChIKey |
SHHJVZLCZARUGZ-UHFFFAOYSA-N |
| Molecular Weight |
316.302 g/mol |
| SMILES |
C1=CC=C(C(F)(F)F)C=C1NC(CSC=1N(C=NN1)C)=O |
![acetamide, 2-[(4-methyl-4H-1,2,4-triazol-3-yl)thio]-N-[3-(trifluoromethyl)phenyl]-](/api/spectrum/FxUomsNOURA/structure.png?h=300&w=458 "acetamide, 2-[(4-methyl-4H-1,2,4-triazol-3-yl)thio]-N-[3-(trifluoromethyl)phenyl]-")
