AC1MD19N
2-[[5-(6-chloro-3-pyridinyl)-4-[3-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]sulfanyl]-1-[3-(trifluoromethyl)phenyl]ethanone
Also Known As: 2-((5-(6-chloro-3-pyridyl)-4-[3-(trifluoromethyl)phenyl]-4h-1,2,4-triazol-3-yl)thio)-1-[3-(trifluoromethyl)phenyl]ethan-1-one|2-[[5-(6-chloropyridin-3-yl)-4-[3-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]sulfanyl]-1-[3-(trifluoromethyl)phenyl]ethanone|2-((5- -4-[3- -1-[3- PHENYL]ETHAN-1-ONE|2-((5-(6-chloropyridin-3-yl)-4-(3-(trifluoromethyl)phenyl)-4H-1,2,4-triazol-3-yl)thio)-1-(3-(trifluoromethyl)phenyl)ethan-1-one|2-({5-(6-chloro-3-pyridyl)-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl}thio)-1-[3-(trifluoromethyl)phenyl]ethan-1-one|2-((5-(6-Chloro-3-pyridyl)-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazole-3-yl)thio-1-[3-(trifluoromethyl)ph|2-((5-(6-Chloro-3-pyridyl)-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazole-3-yl)thio-1-[3-(trifluoromethyl)phenyl]ethan-1-one|2-((5-(6-Chloro-3-pyridyl)-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4triazole-3-yl)thio-1-[3-(trifluoromethyl)phenyl]ethan-1-one|2-((5-(6-CHLORO-PYRIDIN-3-YL)-4-[3-(TRIFLUOROMETHYL)PHENYL]-4H-1,2,4-TRIAZOL-3-YL)THIO)-1-[3-(TRIFLUOROMETHYL)PHENYL]ETHAN-1-ONE|2-({5-(6-Chloro-3-pyridinyl)-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-1-[3-(trifluoromethyl)phenyl]ethanone|2-({5-(6-chloro-3-pyridyl)-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl}thio)-1-[3-(trifluoro|2-({5-(6-Chloropyridin-3-yl)-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-1-[3-(trifluoromethyl)phenyl]ethan-1-one|2-{[5-(6-chloropyridin-3-yl)-4-[3-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]sulfanyl}-1-[3-(trifluoromethyl)phenyl]ethanone
| Molecular Formula | C23H13ClF6N4OS |
|---|---|
| Molecular Weight | 542.0403 g/mol |
| LogP | 6.9953 |
| Topological Polar Surface Area | 60.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 542.0403 |
| Monoisotopic Mass | 542.0403 |
| Heavy Atoms | 36 |
| Complexity | 1402.977 |
Chemical Identifiers
| CAS Number | 680217-03-2 |
|---|---|
| SMILES | C1=CC(=CC(=C1)C(F)(F)F)C(=O)CSC2=NN=C(N2C3=CC=CC(=C3)C(F)(F)F)C4=CN=C(C=C4)Cl |
Product Overview
AC1MD19N (CAS 680217-03-2), with molecular formula C23H13ClF6N4OS and molecular weight 542.0403 g/mol. IUPAC: 2-[[5-(6-chloro-3-pyridinyl)-4-[3-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]sulfanyl]-1-[3-(trifluoromethyl)phenyl]ethanone.
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