Account 1-(Benzo[d][1,3]dioxol-5-yl)-5-((pyrimidin-2-ylthio)methyl)-1H-1,2,3-triazole-4-carboxylic acid
- Catalog No. :
- ACPDPS527
- CAS No. :
- 1416346-84-3
- Molecular Formula :
- C15H11N5O4S
- Molecular Weight :
- 357.35
IUPAC Name:1-(benzo[d][1,3]dioxol-5-yl)-5-((pyrimidin-2-ylthio)methyl)-1H-1,2,3-triazole-4-carboxylic acid
![1-(Benzo[d][1,3]dioxol-5-yl)-5-((pyrimidin-2-ylthio)methyl)-1H-1,2,3-triazole-4-carboxylic acid structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | 1-(Benzo[d][1,3]dioxol-5-yl)-5-((pyrimidin-2-ylthio)methyl)-1H-1,2,3-triazole-4-carboxylic acid |
|---|---|
| IUPAC Name | 1-(benzo[d][1,3]dioxol-5-yl)-5-((pyrimidin-2-ylthio)methyl)-1H-1,2,3-triazole-4-carboxylic acid |
| Molecular Formula | C15H11N5O4S |
| Molecular Weight | 357.35 |
| SMILES | O=C(C1=C(CSC2=NC=CC=N2)N(C3=CC=C(OCO4)C4=C3)N=N1)O |
| InChI Key | NBJZQWUOFVEISB-UHFFFAOYSA-N |
| Synonym | 1-Benzo[1,3]dioxol-5-yl-5-(pyrimidin-2-ylsulfanylmethyl)-1H-[1,2,3]triazole-4-carboxylic acid;1H-1,2,3-Triazole-4-carboxylic acid, 1-(1,3-benzodioxol-5-yl)-5-[(2-pyrimidinylthio)methyl]- |
| CAS No. | 1416346-84-3 |
Safety Data
- Pictogram
- Signal Word
- Achtung
- Hazard Statement(s)
- H302-H315-H319-H335
- Precautionary Statement(s)
- P261-P305+P351+P338
Synthetic Route by SureRoute
2. ACPDPS527 Molecular Building Block Synthetic Route
1-Phenyl-5-((pyrimidin-2-ylthio)methyl)-1H-1,2,3-triazole-4-carboxylic acid
1-(4-Bromophenyl)-5-((pyrimidin-2-ylthio)methyl)-1H-1,2,3-triazole-4-carboxylic acid
1-(4-Fluorophenyl)-5-((pyrimidin-2-ylthio)methyl)-1H-1,2,3-triazole-4-carboxylic acid