Account Ritivixibat
- Catalog No. :
- ACBIDH421
- CAS No. :
- 2460667-52-9
- Molecular Formula :
- C26H36N2O5S2
- Molecular Weight :
- 520.72
IUPAC Name:3-((3,3-dibutyl-7-(methylthio)-1,1-dioxido-5-phenyl-2,3,4,5-tetrahydrobenzo[f][1,2,5]thiadiazepin-8-yl)oxy)propanoic acid
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Product Information
| Product Name | Ritivixibat |
|---|---|
| IUPAC Name | 3-((3,3-dibutyl-7-(methylthio)-1,1-dioxido-5-phenyl-2,3,4,5-tetrahydrobenzo[f][1,2,5]thiadiazepin-8-yl)oxy)propanoic acid |
| Molecular Formula | C26H36N2O5S2 |
| Molecular Weight | 520.72 |
| SMILES | O=C(O)CCOC1=C(SC)C=C(C2=C1)N(C3=CC=CC=C3)CC(CCCC)(CCCC)NS2(=O)=O |
| InChI Key | XHOVXESPVIUTMC-UHFFFAOYSA-N |
| Synonym | Propanoic acid, 3-[{3,3-dibutyl-2,3,4,5-tetrahydro-7-(methylthio)-1,1-dioxido-5-phenyl-1,2,5-benzothiadiazepin-8-yl}oxy]-;Ritivixibat |
| CAS No. | 2460667-52-9 |
Synthetic Route by SureRoute
2. ACBIDH421 Molecular Building Block Synthetic Route
3,3-dibutyl-8-methoxy-7-(methylthio)-5-phenyl-2,3,4,5-tetrahydrobenzo[f][1,2,5]thiadiazepine 1,1-dioxide
2-((3,3-dibutyl-7-(methylthio)-1,1-dioxido-5-phenyl-2,3,4,5-tetrahydrobenzo[f][1,2,5]thiadiazepin-8-yl)oxy)acetic acid
ethyl 2-((3,3-dibutyl-7-(methylthio)-1,1-dioxido-5-phenyl-2,3,4,5-tetrahydrobenzo[f][1,2,5]thiadiazepin-8-yl)oxy)acetate