5-(1,5-dimethyl-1H-pyrazol-3-yl)-4-(4-ethoxyphenyl)-4H-1,2,4-triazole-3-thiol
3-(1,5-dimethylpyrazol-3-yl)-4-(4-ethoxyphenyl)-1H-1,2,4-triazole-5-thione
Also Known As: AK-968/41170017|SR-01000113567-1|5-(1,5-dimethyl-1H-pyrazol-3-yl)-4-(4-ethoxyphenyl)-4H-1,2,4-triazole-3-thiol|3-(1,5-dimethylpyrazol-3-yl)-4-(4-ethoxyphenyl)-1H-1,2,4-triazole-5-thione
CAS: 512809-12-0
| Molecular Formula | C15H17N5OS |
|---|---|
| Molecular Weight | 315.1154 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 86.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 315.1154 |
| Monoisotopic Mass | 315.1154 |
| Heavy Atoms | 22 |
| Complexity | 449.0 |
Chemical Identifiers
| CAS Number | 512809-12-0 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)N2C(=NNC2=S)C3=NN(C(=C3)C)C |
| InChIKey | NHGALEHXEOLQRF-UHFFFAOYSA-N |
Product Overview
5-(1,5-dimethyl-1H-pyrazol-3-yl)-4-(4-ethoxyphenyl)-4H-1,2,4-triazole-3-thiol (CAS 512809-12-0), with molecular formula C15H17N5OS and molecular weight 315.1154 g/mol. IUPAC: 3-(1,5-dimethylpyrazol-3-yl)-4-(4-ethoxyphenyl)-1H-1,2,4-triazole-5-thione.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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5-(1,5-dimethyl-1H-pyrazol-3-yl)-4-(4-ethoxyphenyl)-4H-1,2,4-triazole-3-thiol is a custom synthesis product. We offer services from milligram to kilogram scale.
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