Account Methyl 2-{[4-(prop-2-en-1-ylsulfanyl)-8-thia-3,5-diazatricyclo[7.4.0.0^{2,7}]trideca-1(13),2(7),3,5,9,11-hexaen-6-yl]sulfanyl}benzoate
- Catalog No. :
- ACITQU198
- CAS No. :
- 478030-03-4
- Molecular Formula :
- C21H16N2O2S3
- Molecular Weight :
- 424.57
IUPAC Name:methyl 2-((2-(allylthio)benzo[4,5]thieno[3,2-d]pyrimidin-4-yl)thio)benzoate
![Methyl 2-{[4-(prop-2-en-1-ylsulfanyl)-8-thia-3,5-diazatricyclo[7.4.0.0^{2,7}]trideca-1(13),2(7),3,5,9,11-hexaen-6-yl]sulfanyl}benzoate structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | Methyl 2-{[4-(prop-2-en-1-ylsulfanyl)-8-thia-3,5-diazatricyclo[7.4.0.0^{2,7}]trideca-1(13),2(7),3,5,9,11-hexaen-6-yl]sulfanyl}benzoate |
|---|---|
| IUPAC Name | methyl 2-((2-(allylthio)benzo[4,5]thieno[3,2-d]pyrimidin-4-yl)thio)benzoate |
| Molecular Formula | C21H16N2O2S3 |
| Molecular Weight | 424.57 |
| SMILES | O=C(OC)C1=CC=CC=C1SC2=C3C(C4=CC=CC=C4S3)=NC(SCC=C)=N2 |
| InChI Key | WCOYMBUVRPTTGB-UHFFFAOYSA-N |
| Synonym | METHYL 2-([2-(ALLYLSULFANYL)[1]BENZOTHIENO[3,2-D]PYRIMIDIN-4-YL]SULFANYL)BENZENECARBOXYLATE;methyl 2-{[4-(prop-2-en-1-ylsulfanyl)-8-thia-3,5-diazatricyclo[7.4.0.0^{2,7}]trideca-1(13),2(7),3,5,9,11-hexaen-6-yl]sulfanyl}benzoate;Benzoic acid, 2-[[2-(2-propen-1-ylthio)[1]benzothieno[3,2-d]pyrimidin-4-yl]thio]-, methyl ester |
| CAS No. | 478030-03-4 |
Safety Data
- Pictogram
- Signal Word
- Achtung
- Hazard Statement(s)
- H302-H315-H319-H335
- Precautionary Statement(s)
- P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P330-P362-P403+P233-P501
Synthetic Route by SureRoute
2. ACITQU198 Molecular Building Block Synthetic Route
Methyl 2-{[4-(methylsulfanyl)-8-thia-3,5-diazatricyclo[7.4.0.0^{2,7}]trideca-1(13),2(7),3,5,9,11-hexaen-6-yl]sulfanyl}benzoate
Methyl 2-{[2-(methylsulfanyl)thieno[3,2-d]pyrimidin-4-yl]sulfanyl}benzoate
6-(Phenylsulfanyl)-4-(prop-2-en-1-ylsulfanyl)-8-thia-3,5-diazatricyclo[7.4.0.0^{2,7}]trideca-1(13),2(7),3,5,9,11-hexaene