AC1LR1JB
1-(1,3-benzodioxol-5-yl)-2-[[5-(4-chlorophenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone
Also Known As: 1-(1,3-benzodioxol-5-yl)-2-{[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone|1-(Benzo[d][1,3]dioxol-5-yl)-2-((5-(4-chlorophenyl)-4-(p-tolyl)-4H-1,2,4-triazol-3-yl)thio)ethanone|1-(1,3-Benzodioxol-5-YL)-2-((5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-YL)sulfanyl)ethanone|1-(1,3-benzodioxol-5-yl)-2-[[5-(4-chlorophenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone|1-(2H-1,3-benzodioxol-5-yl)-2-{[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethan-1-one|1-(2H-benzo[3,4-d]1,3-dioxolen-5-yl)-2-[5-(4-chlorophenyl)-4-(4-methylphenyl)( 1,2,4-triazol-3-ylthio)]ethan-1-one|650-679-8
| Molecular Formula | C24H18ClN3O3S |
|---|---|
| Molecular Weight | 463.07574 g/mol |
| LogP | 5.59982 |
| Topological Polar Surface Area | 66.24 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 463.07574 |
| Monoisotopic Mass | 463.07574 |
| Heavy Atoms | 32 |
| Complexity | 1287.0997 |
Chemical Identifiers
| CAS Number | 477332-79-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)C3=CC4=C(C=C3)OCO4)C5=CC=C(C=C5)Cl |
Product Overview
AC1LR1JB (CAS 477332-79-9), with molecular formula C24H18ClN3O3S and molecular weight 463.07574 g/mol. IUPAC: 1-(1,3-benzodioxol-5-yl)-2-[[5-(4-chlorophenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone.
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