4-((4-Tert-butylbenzylidene)amino)-5-(2-pyridinyl)-4H-1,2,4-triazole-3-thiol
4-[(E)-(4-tert-butylphenyl)methylideneamino]-3-pyridin-2-yl-1H-1,2,4-triazole-5-thione
Also Known As: 4-((4-(tert-Butyl)benzylidene)amino)-5-(pyridin-2-yl)-4H-1,2,4-triazole-3-thiol|(E)-4-((4-(tert-butyl)benzylidene)amino)-5-(pyridin-2-yl)-4H-1,2,4-triazole-3-thiol|4-((4-Tert-butylbenzylidene)amino)-5-(2-pyridinyl)-4H-1,2,4-triazole-3-thiol|4-[(E)-(4-tert-butylphenyl)methylideneamino]-3-pyridin-2-yl-1H-1,2,4-triazole-5-thione|4-{(1E)-2-[4-(tert-butyl)phenyl]-1-azavinyl}-5-(2-pyridyl)-1,2,4-triazole-3-th iol|4-{[(E)-(4-tert-butylphenyl)methylidene]amino}-5-(2-pyridinyl)-4H-1,2,4-triazole-3-thiol|4-{[(E)-(4-tert-butylphenyl)methylidene]amino}-5-(pyridin-2-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione|644-088-4
| Molecular Formula | C18H19N5S |
|---|---|
| Molecular Weight | 337.1361 g/mol |
| LogP | 4.18239 |
| Topological Polar Surface Area | 58.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 337.1361 |
| Monoisotopic Mass | 337.1361 |
| Heavy Atoms | 24 |
| Complexity | 899.07733 |
Chemical Identifiers
| CAS Number | 613248-25-2 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)/C=N/N2C(=NNC2=S)C3=CC=CC=N3 |
Product Overview
4-((4-Tert-butylbenzylidene)amino)-5-(2-pyridinyl)-4H-1,2,4-triazole-3-thiol (CAS 613248-25-2), with molecular formula C18H19N5S and molecular weight 337.1361 g/mol. IUPAC: 4-[(E)-(4-tert-butylphenyl)methylideneamino]-3-pyridin-2-yl-1H-1,2,4-triazole-5-thione.