Account Ctrl-CF4-S2
- Catalog No. :
- ACLPMR472
- CAS No. :
- 2365532-65-4
- Molecular Formula :
- C40H51F3N2O2S2
- Molecular Weight :
- 712.99
IUPAC Name:9-(4-((bis(2-(pentylthio)ethyl)amino)methyl)-2-(trifluoromethyl)phenyl)-6-(piperidin-1-yl)-3H-xanthen-3-one
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Product Information
| Product Name | Ctrl-CF4-S2 |
|---|---|
| IUPAC Name | 9-(4-((bis(2-(pentylthio)ethyl)amino)methyl)-2-(trifluoromethyl)phenyl)-6-(piperidin-1-yl)-3H-xanthen-3-one |
| Molecular Formula | C40H51F3N2O2S2 |
| Molecular Weight | 712.99 |
| SMILES | O=C1C=CC=2C(OC=3C=C(C=CC3C2C=4C=CC(=CC4C(F)(F)F)CN(CCSCCCCC)CCSCCCCC)N5CCCCC5)=C1 |
| InChI Key | DHXHRVWDLLWGPB-UHFFFAOYSA-N |
| Synonym | 3H-Xanthen-3-one, 9-[4-[[bis[2-(pentylthio)ethyl]amino]methyl]-2-(trifluoromethyl)phenyl]-6-(1-piperidinyl)-;Ctrl-CF4-S2 |
| CAS No. | 2365532-65-4 |
Synthetic Route by SureRoute
2. ACLPMR472 Molecular Building Block Synthetic Route
9-(4-((Bis(2-((2-(ethylthio)ethyl)thio)ethyl)amino)methyl)-2-(trifluoromethyl)phenyl)-6-(piperidin-1-yl)-3H-xanthen-3-one
2-(6-(Dimethylamino)-3-oxo-3H-xanthen-9-yl)benzoic acid
2-(6-Hydroxy-3-oxo-3H-xanthen-9-yl)-5-((2-(5-((3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanamido)ethyl)carbamoyl)benzoic acid