Account Methyl 2-{[(4E)-4-[(2H-1,3-benzodioxol-5-yl)methylidene]-1-{[4-(2,6-dimethylphenyl)piperazin-1-yl]methyl}-5-oxo-4,5-dihydro-1H-imidazol-2-yl]sulfanyl}acetate
- Catalog No. :
- ACOHDY980
- CAS No. :
- 865659-69-4
- Molecular Formula :
- C27H30N4O5S
- Molecular Weight :
- 522.63
IUPAC Name:methyl (E)-2-((4-(benzo[d][1,3]dioxol-5-ylmethylene)-1-((4-(2,6-dimethylphenyl)piperazin-1-yl)methyl)-5-oxo-4,5-dihydro-1H-imidazol-2-yl)thio)acetate
![Methyl 2-{[(4E)-4-[(2H-1,3-benzodioxol-5-yl)methylidene]-1-{[4-(2,6-dimethylphenyl)piperazin-1-yl]methyl}-5-oxo-4,5-dihydro-1H-imidazol-2-yl]sulfanyl}acetate structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | Methyl 2-{[(4E)-4-[(2H-1,3-benzodioxol-5-yl)methylidene]-1-{[4-(2,6-dimethylphenyl)piperazin-1-yl]methyl}-5-oxo-4,5-dihydro-1H-imidazol-2-yl]sulfanyl}acetate |
|---|---|
| IUPAC Name | methyl (E)-2-((4-(benzo[d][1,3]dioxol-5-ylmethylene)-1-((4-(2,6-dimethylphenyl)piperazin-1-yl)methyl)-5-oxo-4,5-dihydro-1H-imidazol-2-yl)thio)acetate |
| MDL No. | MFCD04125249 |
| Molecular Formula | C27H30N4O5S |
| Molecular Weight | 522.63 |
| SMILES | O=C(OC)CSC1=N/C(C(N1CN2CCN(C3=C(C)C=CC=C3C)CC2)=O)=C/C4=CC=C(OCO5)C5=C4 |
| InChI Key | PLQDNKOFMBOFJF-FYJGNVAPSA-N |
| Synonym | METHYL 2-[(4-(1,3-BENZODIOXOL-5-YLMETHYLENE)-1-([4-(2,6-DIMETHYLPHENYL)PIPERAZINO]METHYL)-5-OXO-4,5-DIHYDRO-1H-IMIDAZOL-2-YL)SULFANYL]ACETATE;methyl 2-{[(4E)-4-[(2H-1,3-benzodioxol-5-yl)methylidene]-1-{[4-(2,6-dimethylphenyl)piperazin-1-yl]methyl}-5-oxo-4,5-dihydro-1H-imidazol-2-yl]sulfanyl}acetate;Acetic acid, 2-[[4-(1,3-benzodioxol-5-ylmethylene)-1-[[4-(2,6-dimethylphenyl)-1-piperazinyl]methyl]-4,5-dihydro-5-oxo-1H-imidazol-2-yl]thio]-, methyl ester |
| CAS No. | 865659-69-4 |
Safety Data
- Pictogram
- Signal Word
- Achtung
- Hazard Statement(s)
- H302-H315-H319-H335
- Precautionary Statement(s)
- P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501
Synthetic Route by SureRoute
2. ACOHDY980 Molecular Building Block Synthetic Route
(4E)-4-[(2H-1,3-Benzodioxol-5-yl)methylidene]-2-[(3,7-dimethyloct-6-en-1-yl)sulfanyl]-1-{[4-(2,6-dimethylphenyl)piperazin-1-yl]methyl}-4,5-dihydro-1H-imidazol-5-one
(4E)-4-[(2H-1,3-Benzodioxol-5-yl)methylidene]-2-(methylsulfanyl)-1-[(4-phenylpiperazin-1-yl)methyl]-4,5-dihydro-1H-imidazol-5-one
(4E)-4-[(2H-1,3-Benzodioxol-5-yl)methylidene]-1-[(4-methylpiperazin-1-yl)methyl]-2-(methylsulfanyl)-4,5-dihydro-1H-imidazol-5-one