| SpectraBase Spectrum ID |
HAwnYdejtgZ |
| Name |
3-{{{2-{[p-(1,3-dithiolan-2-yl)phenoxy]methyl}-4-thiazolyl}methyl}thio-4-methyl-5-(trifluoromethyl)-4H-1,2,4-triazole |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
490.023730367 u |
| Formula |
C18H17F3N4OS4 |
| InChI |
InChI=1S/C18H17F3N4OS4/c1-25-16(18(19,20)21)23-24-17(25)30-10-12-9-29-14(22-12)8-26-13-4-2-11(3-5-13)15-27-6-7-28-15/h2-5,9,15H,6-8,10H2,1H3 |
| InChIKey |
HRTLUKFYEIYXTQ-UHFFFAOYSA-N |
| Molecular Weight |
490.596 g/mol |
| SMILES |
C(F)(F)(F)C=1N(C(=NN1)SCC=1N=C(SC1)COC1=CC=C(C=C1)C1SCCS1)C |
![3-{{{2-{[p-(1,3-dithiolan-2-yl)phenoxy]methyl}-4-thiazolyl}methyl}thio-4-methyl-5-(trifluoromethyl)-4H-1,2,4-triazole](/api/spectrum/HAwnYdejtgZ/structure.png?h=300&w=458 "3-{{{2-{[p-(1,3-dithiolan-2-yl)phenoxy]methyl}-4-thiazolyl}methyl}thio-4-methyl-5-(trifluoromethyl)-4H-1,2,4-triazole")
