5-(4-ethoxyphenyl)-4-methyl-4H-1,2,4-triazole-3-thiol
3-(4-ethoxyphenyl)-4-methyl-1H-1,2,4-triazole-5-thione
Also Known As: 5-(4-ethoxyphenyl)-4-methyl-4H-1,2,4-triazole-3-thiol|Antimony,compd. with barium (2:1)|SDCCGMLS-0064983.P001|3-(4-ethoxyphenyl)-4-methyl-1H-1,2,4-triazole-5-thione|5-(4-ethoxyphenyl)-4-methyl-1,2,4-triazole-3-thiol|AG-690/12893042|SR-01000500477-1|5-(4-Ethoxy-phenyl)-4-methyl-2,4-dihydro-[1,2,4]tr|5-(4-ethoxyphenyl)-4-methyl-2,4-dihydro-3H-1,2,4-triazole-3-thione|5-(4-ETHOXYPHENYL)-4-METHYL-2H-1,2,4-TRIAZOLE-3-THIONE|3-(4-ETHOXYPHENYL)-4-METHYL-4,5-DIHYDRO-1H-1,2,4-TRIAZOLE-5-THIONE
| Molecular Formula | C11H13N3OS |
|---|---|
| Molecular Weight | 235.07793 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 69.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 235.07793 |
| Monoisotopic Mass | 235.07793 |
| Heavy Atoms | 16 |
| Complexity | 298.0 |
Chemical Identifiers
| CAS Number | 334497-06-2 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)C2=NNC(=S)N2C |
| InChIKey | LZFBQLLJKSXZST-UHFFFAOYSA-N |
Product Overview
5-(4-ethoxyphenyl)-4-methyl-4H-1,2,4-triazole-3-thiol (CAS 334497-06-2), with molecular formula C11H13N3OS and molecular weight 235.07793 g/mol. IUPAC: 3-(4-ethoxyphenyl)-4-methyl-1H-1,2,4-triazole-5-thione.