Account 1-({5-(6-chloro-3-pyridyl)-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl}thio)-3,3-dimethylbutan-2-one
- Catalog No. :
- ACUKDZ193
- CAS No. :
- 680217-04-3
- Molecular Formula :
- C20H18ClF3N4OS
- Molecular Weight :
- 454.90
IUPAC Name:1-((5-(6-chloropyridin-3-yl)-4-(3-(trifluoromethyl)phenyl)-4H-1,2,4-triazol-3-yl)thio)-3,3-dimethylbutan-2-one
![1-({5-(6-chloro-3-pyridyl)-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl}thio)-3,3-dimethylbutan-2-one structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | 1-({5-(6-chloro-3-pyridyl)-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl}thio)-3,3-dimethylbutan-2-one |
|---|---|
| IUPAC Name | 1-((5-(6-chloropyridin-3-yl)-4-(3-(trifluoromethyl)phenyl)-4H-1,2,4-triazol-3-yl)thio)-3,3-dimethylbutan-2-one |
| MDL No. | MFCD00275139 |
| Molecular Formula | C20H18ClF3N4OS |
| Molecular Weight | 454.90 |
| SMILES | CC(C)(C)C(CSC1=NN=C(C2=CC=C(Cl)N=C2)N1C3=CC=CC(C(F)(F)F)=C3)=O |
| InChI Key | ITFMGKQYEHCAIG-UHFFFAOYSA-N |
| Synonym | 2-Butanone, 1-[[5-(6-chloro-3-pyridinyl)-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl]thio]-3,3-dimethyl- |
| CAS No. | 680217-04-3 |
Safety Data
- Pictogram
- Signal Word
- Achtung
- Hazard Statement(s)
- H302-H315-H319-H335
- Precautionary Statement(s)
- P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P330-P362-P403+P233-P501
Synthetic Route by SureRoute
2. ACUKDZ193 Molecular Building Block Synthetic Route
2-chloro-5-{5-(prop-2-ynylthio)-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl}pyridine
2-Chloro-5-{5-(methylthio)-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl}pyridine
2-({5-(6-chloro-3-pyridyl)-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl}thio)-1-phenylethan-1-one