RefChem:449154
2-[(4-ethyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide
Also Known As: 2-{[4-ethyl-5-(3-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[3-(trifluoromethyl)phenyl]acetamide|BAS 02241109|AG-690/40752798|2-{[4-ethyl-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[3-(trifluoromethyl)phenyl]acetamide|2-((4-Ethyl-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(3-(trifluoromethyl)phenyl)acetamide|2-[(4-ethyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide|2-((4-Ethyl-5-(3-pyridinyl)-4H-1,2,4-triazol-3-YL)sulfanyl)-N-(3-(trifluoromethyl)phenyl)acetamide|2-(4-ethyl-5-(3-pyridyl)(1,2,4-triazol-3-ylthio))-N-[3-(trifluoromethyl)phenyl ]acetamide|649-327-6
| Molecular Formula | C18H16F3N5OS |
|---|---|
| Molecular Weight | 407.10275 g/mol |
| LogP | 4.1096 |
| Topological Polar Surface Area | 72.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 407.10275 |
| Monoisotopic Mass | 407.10275 |
| Heavy Atoms | 28 |
| Complexity | 959.355 |
Chemical Identifiers
| CAS Number | 333331-34-3 |
|---|---|
| SMILES | CCN1C(=NN=C1SCC(=O)NC2=CC=CC(=C2)C(F)(F)F)C3=CN=CC=C3 |
Product Overview
RefChem:449154 (CAS 333331-34-3), with molecular formula C18H16F3N5OS and molecular weight 407.10275 g/mol. IUPAC: 2-[(4-ethyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide.
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