AC1NIQOA
N-(4-butan-2-ylphenyl)-2-[[5-(2-chlorophenyl)-4-(furan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: N-[4-(butan-2-yl)phenyl]-2-{[5-(2-chlorophenyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide|2-[5-(2-chlorophenyl)-4-(2-furylmethyl)(1,2,4-triazol-3-ylthio)]-N-[4-(methylp ropyl)phenyl]acetamide|N-(4-(sec-butyl)phenyl)-2-((5-(2-chlorophenyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl)thio)acetamide|N-(4-butan-2-ylphenyl)-2-[[5-(2-chlorophenyl)-4-(furan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
| Molecular Formula | C25H25ClN4O2S |
|---|---|
| Molecular Weight | 480.13867 g/mol |
| LogP | 6.4841 |
| Topological Polar Surface Area | 72.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 480.13867 |
| Monoisotopic Mass | 480.13867 |
| Heavy Atoms | 33 |
| Complexity | 1205.6422 |
Chemical Identifiers
| CAS Number | 896594-95-9 |
|---|---|
| SMILES | CCC(C)C1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2CC3=CC=CO3)C4=CC=CC=C4Cl |
Product Overview
AC1NIQOA (CAS 896594-95-9), with molecular formula C25H25ClN4O2S and molecular weight 480.13867 g/mol. IUPAC: N-(4-butan-2-ylphenyl)-2-[[5-(2-chlorophenyl)-4-(furan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide.
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