Simeprevir (Standard)
cas: 923604-59-5 — see every product listed under this CAS number, including other names
Simeprevir (Standard) (CAS 923604-59-5) is a chemical reagent available from Chemat. Available pack sizes: Get quote. Offered by: MedChemExpress.
| brand | MedChemExpress |
|---|---|
| catalog number | HY-10241R-Get quote |
| cas | 923604-59-5 |
| size | Get quote |
| availability | Get quote |
Need more information?
Ask us about this product — we're happy to help.
Available pack sizes
| brand | size | price | |
|---|---|---|---|
| MedChemExpress | Get quote | price on request |
properties
| delivery time | to confirm by Chemat |
|---|---|
| purity | no data |
Simeprevir is a lactam and an azamacrocycle.
Source: ChEBI
| Molecular formula | C38H47N5O7S2 |
|---|---|
| Molecular weight | 749.9 g/mol |
| IUPAC name | (1R,4R,6S,7Z,15R,17R)-N-cyclopropylsulfonyl-17-[7-methoxy-8-methyl-2-(4-propan-2-yl-1,3-thiazol-2-yl)quinolin-4-yl]oxy-13-methyl-2,14-dioxo-3,13-diazatricyclo[13.3.0.04,6]octadec-7-ene-4-carboxamide |
| InChIKey | JTZZSQYMACOLNN-VDWJNHBNSA-N |
| SMILES | CC1=C(C=CC2=C1N=C(C=C2O[C@@H]3C[C@@H]4[C@@H](C3)C(=O)N(CCCC/C=C\[C@@H]5C[C@]5(NC4=O)C(=O)NS(=O)(=O)C6CC6)C)C7=NC(=CS7)C(C)C)OC |
Computed by PubChem (NCBI)