2-[(4-Ethyl-5-pyrazin-2-yl-1,2,4-triazol-3-yl)sulfanyl]-1-phenylethanone
2-[(4-ethyl-5-pyrazin-2-yl-1,2,4-triazol-3-yl)sulfanyl]-1-phenylethanone
Also Known As: 2-[(4-ethyl-5-pyrazin-2-yl-1,2,4-triazol-3-yl)sulfanyl]-1-phenylethanone|2-(4-ethyl-5-pyrazin-2-yl(1,2,4-triazol-3-ylthio))-1-phenylethan-1-one|2-[(4-ethyl-5-pyrazin-2-yl-1,2,4-triazol-3-yl)thio]-1-phenyl-ethanone|2-[[4-ethyl-5-(2-pyrazinyl)-1,2,4-triazol-3-yl]thio]-1-phenylethanone|2-((4-ethyl-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl)thio)-1-phenylethanone|2-[(4-ethyl-5-pyrazin-2-yl-1,2,4-triazol-3-yl)sulfanyl]-1-phenyl-ethanone|2-{[4-ethyl-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-phenylethan-1-one|2-{[4-ethyl-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-phenylethanone
| Molecular Formula | C16H15N5OS |
|---|---|
| Molecular Weight | 325.09973 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 98.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 325.09973 |
| Monoisotopic Mass | 325.09973 |
| Heavy Atoms | 23 |
| Complexity | 391.0 |
Chemical Identifiers
| CAS Number | 577984-74-8 |
|---|---|
| SMILES | CCN1C(=NN=C1SCC(=O)C2=CC=CC=C2)C3=NC=CN=C3 |
| InChIKey | NBWOSFMRMMWDNQ-UHFFFAOYSA-N |
Product Overview
2-[(4-Ethyl-5-pyrazin-2-yl-1,2,4-triazol-3-yl)sulfanyl]-1-phenylethanone (CAS 577984-74-8), with molecular formula C16H15N5OS and molecular weight 325.09973 g/mol. IUPAC: 2-[(4-ethyl-5-pyrazin-2-yl-1,2,4-triazol-3-yl)sulfanyl]-1-phenylethanone.