AC1LL7JR
2-[[5-(4-chlorophenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-ethylphenyl)acetamide
Also Known As: BAS 02223775|2-{[5-(4-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-ethylphenyl)acetamide|2-[[5-(4-chlorophenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-ethylphenyl)acetamide|AG-690/40752261|2-((5-(4-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl)thio)-N-(4-ethylphenyl)acetamide|2-[5-(4-chlorophenyl)-4-ethyl(1,2,4-triazol-3-ylthio)]-N-(4-ethylphenyl)acetam ide
| Molecular Formula | C20H21ClN4OS |
|---|---|
| Molecular Weight | 400.11246 g/mol |
| LogP | 4.9116 |
| Topological Polar Surface Area | 59.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 400.11246 |
| Monoisotopic Mass | 400.11246 |
| Heavy Atoms | 27 |
| Complexity | 906.7361 |
Chemical Identifiers
| CAS Number | 333323-58-3 |
|---|---|
| SMILES | CCC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2CC)C3=CC=C(C=C3)Cl |
Product Overview
AC1LL7JR (CAS 333323-58-3), with molecular formula C20H21ClN4OS and molecular weight 400.11246 g/mol. IUPAC: 2-[[5-(4-chlorophenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-ethylphenyl)acetamide.
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