AC1NNQQV
N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[[5-(4-methylphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: N-[4-chloro-3-(trifluoromethyl)phenyl]-2-{[5-(4-methylphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide|2-((4-allyl-5-(p-tolyl)-4H-1,2,4-triazol-3-yl)thio)-N-(4-chloro-3-(trifluoromethyl)phenyl)acetamide|N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[[5-(4-methylphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]acetamide|N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[5-(4-methylphenyl)-4-prop-2-enyl(1,2 ,4-triazol-3-ylthio)]acetamide
| Molecular Formula | C21H18ClF3N4OS |
|---|---|
| Molecular Weight | 466.0842 g/mol |
| LogP | 5.84252 |
| Topological Polar Surface Area | 59.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 466.0842 |
| Monoisotopic Mass | 466.0842 |
| Heavy Atoms | 31 |
| Complexity | 1096.9946 |
Chemical Identifiers
| CAS Number | 862184-89-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=NN=C(N2CC=C)SCC(=O)NC3=CC(=C(C=C3)Cl)C(F)(F)F |
Product Overview
AC1NNQQV (CAS 862184-89-2), with molecular formula C21H18ClF3N4OS and molecular weight 466.0842 g/mol. IUPAC: N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[[5-(4-methylphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]acetamide.