AC1LR8V4
3-[5-[(3-chlorophenyl)methylsulfanyl]-4-(4-ethoxyphenyl)-1,2,4-triazol-3-yl]pyridine
Also Known As: 3-[5-[(3-chlorobenzyl)sulfanyl]-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl]pyridine|3-[5-[(3-chlorophenyl)methylsulfanyl]-4-(4-ethoxyphenyl)-1,2,4-triazol-3-yl]pyridine|1-{3-[(3-chlorophenyl)methylthio]-5-(3-pyridyl)(1,2,4-triazol-4-yl)}-4-ethoxyb enzene|3-(5-((3-chlorobenzyl)thio)-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl)pyridine|3-{5-[(3-chlorobenzyl)sulfanyl]-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl}pyridine|3-(5-{[(3-chlorophenyl)methyl]sulfanyl}-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl)pyridine
| Molecular Formula | C22H19ClN4OS |
|---|---|
| Molecular Weight | 422.0968 g/mol |
| LogP | 5.6737 |
| Topological Polar Surface Area | 52.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 422.0968 |
| Monoisotopic Mass | 422.0968 |
| Heavy Atoms | 29 |
| Complexity | 1083.6848 |
Chemical Identifiers
| CAS Number | 613227-40-0 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC(=CC=C3)Cl)C4=CN=CC=C4 |
Product Overview
AC1LR8V4 (CAS 613227-40-0), with molecular formula C22H19ClN4OS and molecular weight 422.0968 g/mol. IUPAC: 3-[5-[(3-chlorophenyl)methylsulfanyl]-4-(4-ethoxyphenyl)-1,2,4-triazol-3-yl]pyridine.
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