AC1NTOUY
2-(1,3-benzothiazol-2-yl)-4-[N-(2-hydroxy-5-methylphenyl)-C-methylcarbonimidoyl]-5-(trifluoromethyl)-1H-pyrazol-3-one
Also Known As: AJ-292/14241001|AK-968/12163679|AK-968/37172017|2-(1,3-benzothiazol-2-yl)-4-[(1E)-N-(2-hydroxy-5-methylphenyl)ethanimidoyl]-5-(trifluoromethyl)-1,2-dihydro-3H-pyrazol-3-one|2-(1,3-Benzothiazol-2-yl)-4-[N-(2-hydroxy-5-methylphenyl)-C-methylcarbonimidoyl]-5-(trifluoromethyl)-1H-pyrazol-3-one|(4E)-2-(1,3-benzothiazol-2-yl)-4-[1-(2-hydroxy-5-methylanilino)ethylidene]-5-(trifluoromethyl)pyrazol-3-one|(4Z)-2-(1,3-benzothiazol-2-yl)-4-[1-(2-hydroxy-5-methylanilino)ethylidene]-5-(trifluoromethyl)pyrazol-3-one|(E)-2-(benzo[d]thiazol-2-yl)-4-(1-((2-hydroxy-5-methylphenyl)imino)ethyl)-5-(trifluoromethyl)-1H-pyrazol-3(2H)-one|2-(1,3-BENZOTHIAZOL-2-YL)-4-[(1E)-1-[(2-HYDROXY-5-METHYLPHENYL)IMINO]ETHYL]-5-(TRIFLUOROMETHYL)-1H-PYRAZOL-3-ONE|2-(1,3-BENZOTHIAZOL-2-YL)-4-[(1E)-1-[(2-HYDROXY-5-METHYLPHENYL)IMINO]ETHYL]-5-(TRIFLUOROMETHYL)-2,3-DIHYDRO-1H-PYRAZOL-3-ONE|2-(1,3-benzothiazol-2-yl)-4-[1-(2-hydroxy-5-methylanilino)ethylidene]-5-(trifluoromethyl)-2,4-dihydro-3H-pyrazol-3-one|2-(1,3-benzothiazol-2-yl)-4-[1-(2-hydroxy-5-methylanilino)ethylidene]-5-(trifluoromethyl)pyrazol-3-one
| Molecular Formula | C20H15F3N4O2S |
|---|---|
| Molecular Weight | 432.0868 g/mol |
| LogP | 4.94882 |
| Topological Polar Surface Area | 83.27 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 432.0868 |
| Monoisotopic Mass | 432.0868 |
| Heavy Atoms | 30 |
| Complexity | 1315.3329 |
Chemical Identifiers
| CAS Number | 354546-39-7 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)O)N=C(C)C2=C(NN(C2=O)C3=NC4=CC=CC=C4S3)C(F)(F)F |
Product Overview
AC1NTOUY (CAS 354546-39-7), with molecular formula C20H15F3N4O2S and molecular weight 432.0868 g/mol. IUPAC: 2-(1,3-benzothiazol-2-yl)-4-[N-(2-hydroxy-5-methylphenyl)-C-methylcarbonimidoyl]-5-(trifluoromethyl)-1H-pyrazol-3-one.