Account 2-{[5-(4-tert-butylphenyl)-4-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetic acid
- Catalog No. :
- ACPJOS583
- CAS No. :
- 893727-59-8
- Molecular Formula :
- C20H20ClN3O2S
- Molecular Weight :
- 401.92
IUPAC Name:2-((5-(4-(tert-butyl)phenyl)-4-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl)thio)acetic acid
![2-{[5-(4-tert-butylphenyl)-4-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetic acid structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | 2-{[5-(4-tert-butylphenyl)-4-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetic acid |
|---|---|
| IUPAC Name | 2-((5-(4-(tert-butyl)phenyl)-4-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl)thio)acetic acid |
| MDL No. | MFCD07364360 |
| Molecular Formula | C20H20ClN3O2S |
| Molecular Weight | 401.92 |
| SMILES | O=C(O)CSC1=NN=C(C2=CC=C(C(C)(C)C)C=C2)N1C3=CC=C(Cl)C=C3 |
| InChI Key | DCTILTYGXQNNSG-UHFFFAOYSA-N |
| Synonym | Acetic acid, 2-[[4-(4-chlorophenyl)-5-[4-(1,1-dimethylethyl)phenyl]-4H-1,2,4-triazol-3-yl]thio]-;2-{[5-(4-tert-Butylphenyl)-4-(4-chlorophenyl)-4h-1,2,4-triazol-3-yl]sulfanyl}acetic acid |
| CAS No. | 893727-59-8 |
Safety Data
- Pictogram
- Signal Word
- Warning
- Hazard Statement(s)
- H302-H312-H332
- Precautionary Statement(s)
- P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P330-P363-P501
Synthetic Route by SureRoute
2. ACPJOS583 Molecular Building Block Synthetic Route
2-{[5-(4-tert-butylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetic acid
2-{[5-(4-tert-butylphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetic acid
2-((4-(4-Chlorophenyl)-5-phenyl-4H-1,2,4-triazol-3-yl)thio)acetic acid