AC1OBNIY
4-[(E)-(2-chloro-6-fluorophenyl)methylideneamino]-3-[4-(dimethylamino)phenyl]-1H-1,2,4-triazole-5-thione
Also Known As: 4-((2-CL-6-F-BENZYLIDENE)AMINO)-5-(4-(DIMETHYLAMINO)PH)4H-1,2,4-TRIAZOLE-3-THIOL|(E)-4-((2-chloro-6-fluorobenzylidene)amino)-5-(4-(dimethylamino)phenyl)-4H-1,2,4-triazole-3-thiol|4-[(1E)-2-(6-chloro-2-fluorophenyl)-1-azavinyl]-5-[4-(dimethylamino)phenyl]-1, 2,4-triazole-3-thiol|4-[(E)-(2-chloro-6-fluorophenyl)methylideneamino]-3-(4-dimethylaminophenyl)-1H-1,2,4-triazole-5-thione|4-{[(E)-(2-chloro-6-fluorophenyl)methylidene]amino}-5-[4-(dimethylamino)phenyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
| Molecular Formula | C17H15ClFN5S |
|---|---|
| Molecular Weight | 375.07208 g/mol |
| LogP | 4.34839 |
| Topological Polar Surface Area | 49.21 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 375.07208 |
| Monoisotopic Mass | 375.07208 |
| Heavy Atoms | 25 |
| Complexity | 955.1984 |
Chemical Identifiers
| CAS Number | 613250-68-3 |
|---|---|
| SMILES | CN(C)C1=CC=C(C=C1)C2=NNC(=S)N2/N=C/C3=C(C=CC=C3Cl)F |
Product Overview
AC1OBNIY (CAS 613250-68-3), with molecular formula C17H15ClFN5S and molecular weight 375.07208 g/mol. IUPAC: 4-[(E)-(2-chloro-6-fluorophenyl)methylideneamino]-3-[4-(dimethylamino)phenyl]-1H-1,2,4-triazole-5-thione.
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