3-[(2,4-dimethylphenoxy)methyl]-4-phenyl-1H-1,2,4-triazole-5-thione
3-[(2,4-dimethylphenoxy)methyl]-4-phenyl-1H-1,2,4-triazole-5-thione
Also Known As: KS-00003NU7|3-[(2,4-dimethylphenoxy)methyl]-4-phenyl-1H-1,2,4-triazole-5-thione|3-((2,4-DIMETHYLPHENOXY)METHYL)-4-PHENYL-1,2,4-TRIAZOLINE-5-THIONE|5-(2,4-dimethylphenoxymethyl)-4-phenyl-2H-1,2,4-triazole-3-thione|5-[(2,4-dimethylphenoxy)methyl]-4-phenyl-2H-1,2,4-triazole-3-thione|3-[(2,4-dimethylphenoxy)methyl]-4-phenyl-4,5-dihydro-1H-1,2,4-triazole-5-thione|5-((2,4-Dimethylphenoxy)methyl)-4-phenyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
| Molecular Formula | C17H17N3OS |
|---|---|
| Molecular Weight | 311.10922 g/mol |
| LogP | 4.12573 |
| Topological Polar Surface Area | 42.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 311.10922 |
| Monoisotopic Mass | 311.10922 |
| Heavy Atoms | 22 |
| Complexity | 836.6104 |
Chemical Identifiers
| CAS Number | 76151-18-3 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)OCC2=NNC(=S)N2C3=CC=CC=C3)C |
Product Overview
3-[(2,4-dimethylphenoxy)methyl]-4-phenyl-1H-1,2,4-triazole-5-thione (CAS 76151-18-3), with molecular formula C17H17N3OS and molecular weight 311.10922 g/mol. IUPAC: 3-[(2,4-dimethylphenoxy)methyl]-4-phenyl-1H-1,2,4-triazole-5-thione.