AC1NJUX2
2-[[4-amino-5-(5-methyl-1H-pyrazol-3-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-ethylphenyl)acetamide
Also Known As: 2-[[4-amino-5-(5-methyl-1H-pyrazol-3-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-ethylphenyl)acetamide|2-[4-amino-5-(3-methylpyrazol-5-yl)(1,2,4-triazol-3-ylthio)]-N-(2-ethylphenyl) acetamide|2-((4-amino-5-(3-methyl-1H-pyrazol-5-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(2-ethylphenyl)acetamide|2-{[4-amino-5-(3-methyl-1H-pyrazol-5-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-ethylphenyl)acetamide
| Molecular Formula | C16H19N7OS |
|---|---|
| Molecular Weight | 357.13718 g/mol |
| LogP | 1.98362 |
| Topological Polar Surface Area | 114.51 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 357.13718 |
| Monoisotopic Mass | 357.13718 |
| Heavy Atoms | 25 |
| Complexity | 886.24805 |
Chemical Identifiers
| CAS Number | 879474-55-2 |
|---|---|
| SMILES | CCC1=CC=CC=C1NC(=O)CSC2=NN=C(N2N)C3=NNC(=C3)C |
Product Overview
AC1NJUX2 (CAS 879474-55-2), with molecular formula C16H19N7OS and molecular weight 357.13718 g/mol. IUPAC: 2-[[4-amino-5-(5-methyl-1H-pyrazol-3-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-ethylphenyl)acetamide.
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