| SpectraBase Spectrum ID |
197dLmkkT0T |
| Name |
4-(Benzimido)-3-S-[2-(methoxyimino)(methoxycarbonyl)methyl]benzylmercapto-5-(trifluoromethyl)-1,2,4-triazole |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H18F3N5O3S |
| InChI |
InChI=1S/C21H18F3N5O3S/c1-31-18(30)17(28-32-2)16-11-7-6-10-15(16)13-33-20-27-26-19(21(22,23)24)29(20)25-12-14-8-4-3-5-9-14/h3-12H,13H2,1-2H3/b25-12+,28-17+ |
| InChIKey |
YDYSLSHPCDEIPN-XEUOXSNKSA-N |
| Molecular Weight |
477.462 g/mol |
| SMILES |
c1([n](c(nn1)SCc1c(\C(C(=O)OC)=N/OC)cccc1)\N=C\c1ccccc1)C(F)(F)F |
| SPLASH |
splash10-0aor-4980000000-f11241791e0785c595e8 |
| Source of Spectrum |
Y-51-1347-3a |
| Synonyms |
(E)-methyl 2-(2-(((4-((E)-benzylideneamino)-5-(trifluoromethyl)-4H-1,2,4-triazol-3-yl)thio)methyl)phenyl)-2-(methoxyimino)acetate |
| Wiley ID |
1741522 |
![4-(Benzimido)-3-S-[2-(methoxyimino)(methoxycarbonyl)methyl]benzylmercapto-5-(trifluoromethyl)-1,2,4-triazole](/api/spectrum/197dLmkkT0T/structure.png?h=300&w=458 "4-(Benzimido)-3-S-[2-(methoxyimino)(methoxycarbonyl)methyl]benzylmercapto-5-(trifluoromethyl)-1,2,4-triazole")
