Account Simeprevir Sodium
- Catalog No. :
- ACKHXD558
- CAS No. :
- 1241946-89-3
- Molecular Formula :
- C38H47N5NaO7S2
- Molecular Weight :
- 772.95
IUPAC Name:(2R,3aR,11aS,12aR,14aR,Z)-N-(cyclopropylsulfonyl)-2-((2-(4-isopropylthiazol-2-yl)-7-methoxy-8-methylquinolin-4-yl)oxy)-5-methyl-4,14-dioxo-2,3,3a,4,5,6,7,8,9,11a,12,13,14,14a-tetradecahydrocyclopenta[c]cyclopropa[g][1,6]diazacyclotetradecine-12a(1H)-carboxamide, sodium salt
Pack SizePurityList PriceYour PriceGlobal StockUS StockQuantity
No pack options available.
Products of AiFChem are all designed for scientific research only. Under no circumstances do we provide products or services for animal or personal utilization.
0 Reviews:View Reviews
Product Information
| Product Name | Simeprevir Sodium |
|---|---|
| IUPAC Name | (2R,3aR,11aS,12aR,14aR,Z)-N-(cyclopropylsulfonyl)-2-((2-(4-isopropylthiazol-2-yl)-7-methoxy-8-methylquinolin-4-yl)oxy)-5-methyl-4,14-dioxo-2,3,3a,4,5,6,7,8,9,11a,12,13,14,14a-tetradecahydrocyclopenta[c]cyclopropa[g][1,6]diazacyclotetradecine-12a(1H)-carboxamide, sodium salt |
| Molecular Formula | C38H47N5NaO7S2 |
| Molecular Weight | 772.95 |
| SMILES | COC1=CC=C2C(O[C@@H]3C[C@H]4C(=O)N[C@]5(C(=O)NS(=O)(=O)C6CC6)C[C@H]5/C=C\CCCCN(C)C(=O)[C@@H]4C3)=CC(C3=NC(C(C)C)=CS3)=NC2=C1C.[Na] |
| InChI Key | SJIUGRVSGNDZRS-MVZLLIIPSA-N |
| Synonym | Simeprevir sodium | SIMEPREVIR SODIUM [WHO-DD] | SIMEPREVIR SODIUM [ORANGE BOOK] | Olysio | AKOS040744818 | CHEMBL3137358 | Monosodium (cyclopropylsulfonyl)((2R,3aR,10Z,11aS,12aR,14aR)-2-((7-methoxy-8-methyl-2-(4-(1-methylethyl)-1,3-thiazol-2-yl)quinolin- |
| CAS No. | 1241946-89-3 |
| PubChem CID | 46866715 |
Synthetic Route by SureRoute
2. ACKHXD558 Molecular Building Block Synthetic Route
(2R,3aR,11aS,12aR,14aR,Z)-N-(Cyclopropylsulfonyl)-2-((2-(4-isopropylthiazol-2-yl)-7-methoxy-8-methylquinolin-4-yl)oxy)-5-methyl-4,14-dioxo-2,3,3a,4,5,6,7,8,9,11a,12,13,14,14a-tetradecahydrocyclopenta[c]cyclopropa[g][1,6]diazacyclotetradecine-12a(1H)-carboxamide
(2R,3aR,11aS,12aR,14aR)-N-(cyclopropylsulfonyl)-2-((2-(4-isopropylthiazol-2-yl)-7-methoxy-8-methylquinolin-4-yl)oxy)-5-methyl-4,14-dioxo-2,3,3a,4,5,6,7,8,9,11a,12,13,14,14a-tetradecahydrocyclopenta[c]cyclopropa[g][1,6]diazacyclotetradecine-12a(1H)-carboxamide
Deldeprevir Na