AC1MNRFH
N-[[4-(3-chlorophenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]methyl]-2-(trifluoromethyl)benzamide
Also Known As: SR-01000442437-1|F0475-0172|N-{[4-(3-chlorophenyl)-5-sulfanylidene-4,5-dihydro-1H-1,2,4-triazol-3-yl]methyl}-2-(trifluoromethyl)benzamide|N-[[4-(3-chlorophenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]methyl]-2-(trifluoromethyl)benzamide|N-((4-(3-chlorophenyl)-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-3-yl)methyl)-2-(trifluoromethyl)benzamide
| Molecular Formula | C17H12ClF3N4OS |
|---|---|
| Molecular Weight | 412.03723 g/mol |
| LogP | 4.53209 |
| Topological Polar Surface Area | 62.71 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 412.03723 |
| Monoisotopic Mass | 412.03723 |
| Heavy Atoms | 27 |
| Complexity | 1044.8981 |
Chemical Identifiers
| CAS Number | 391887-14-2 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)NCC2=NNC(=S)N2C3=CC(=CC=C3)Cl)C(F)(F)F |
Product Overview
AC1MNRFH (CAS 391887-14-2), with molecular formula C17H12ClF3N4OS and molecular weight 412.03723 g/mol. IUPAC: N-[[4-(3-chlorophenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]methyl]-2-(trifluoromethyl)benzamide.
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