Account Methyl ((S)-1-((S)-2-(6-((1R,4S)-8-(4-(2-((S)-1-((methoxycarbonyl)-L-valyl)pyrrolidin-2-yl)-1H-imidazol-5-yl)phenyl)-1,2,3,4-tetrahydro-1,4-methanonaphthalen-5-yl)-1H-benzo[d]imidazol-2-yl)pyrrolidin-1-yl)-3-methyl-1-oxobutan-2-yl)carbamate
- Catalog No. :
- ACZOPQ622
- CAS No. :
- 1959593-23-7
- Molecular Formula :
- C49H58N8O6
- Molecular Weight :
- 855.05
IUPAC Name:methyl ((S)-1-((S)-2-(5-(4-((1S,4R)-8-(2-((S)-1-((methoxycarbonyl)-L-valyl)pyrrolidin-2-yl)-1H-benzo[d]imidazol-6-yl)-1,2,3,4-tetrahydro-1,4-methanonaphthalen-5-yl)phenyl)-1H-imidazol-2-yl)pyrrolidin-1-yl)-3-methyl-1-oxobutan-2-yl)carbamate
![Methyl ((S)-1-((S)-2-(6-((1R,4S)-8-(4-(2-((S)-1-((methoxycarbonyl)-L-valyl)pyrrolidin-2-yl)-1H-imidazol-5-yl)phenyl)-1,2,3,4-tetrahydro-1,4-methanonaphthalen-5-yl)-1H-benzo[d]imidazol-2-yl)pyrrolidin-1-yl)-3-methyl-1-oxobutan-2-yl)carbamate structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | Methyl ((S)-1-((S)-2-(6-((1R,4S)-8-(4-(2-((S)-1-((methoxycarbonyl)-L-valyl)pyrrolidin-2-yl)-1H-imidazol-5-yl)phenyl)-1,2,3,4-tetrahydro-1,4-methanonaphthalen-5-yl)-1H-benzo[d]imidazol-2-yl)pyrrolidin-1-yl)-3-methyl-1-oxobutan-2-yl)carbamate |
|---|---|
| IUPAC Name | methyl ((S)-1-((S)-2-(5-(4-((1S,4R)-8-(2-((S)-1-((methoxycarbonyl)-L-valyl)pyrrolidin-2-yl)-1H-benzo[d]imidazol-6-yl)-1,2,3,4-tetrahydro-1,4-methanonaphthalen-5-yl)phenyl)-1H-imidazol-2-yl)pyrrolidin-1-yl)-3-methyl-1-oxobutan-2-yl)carbamate |
| Molecular Formula | C49H58N8O6 |
| Molecular Weight | 855.05 |
| SMILES | C([C@@H](NC(OC)=O)C(C)C)(=O)N1[C@](C=2NC3=CC(C4=C5C(=C(C=C4)C6=CC=C(C=C6)C=7NC(=NC7)[C@]8(N(C([C@@H](NC(OC)=O)C(C)C)=O)CCC8)[H])[C@H]9C[C@@H]5CC9)=CC=C3N2)(CCC1)[H] |
| InChI Key | CMLNPOWEANUBIB-XIGHHNHFSA-N |
| Synonym | Carbamic acid, N-[(1S)-2-methyl-1-[[(2S)-2-[5-[4-[(1S,4R)-1,2,3,4-tetrahydro-8-[2-[(2S)-1-[(2S)-2-[(methoxycarbonyl)amino]-3-methyl-1-oxobutyl]-2-pyrrolidinyl]-1H-benzimidazol-6-yl]-1,4-methanonaphthalen-5-yl]phenyl]-1H-imidazol-2-yl]-1-pyrrolidinyl]carbonyl]propyl]-, methyl ester |
| CAS No. | 1959593-23-7 |
Synthetic Route by SureRoute
2. ACZOPQ622 Molecular Building Block Synthetic Route
Methyl ((S)-1-((S)-2-(6-((1R,4S)-8-(4-(2-((S)-1-((methoxycarbonyl)-L-valyl)pyrrolidin-2-yl)-1H-imidazol-5-yl)phenyl)-1,2,3,4-tetrahydro-1,4-methanonaphthalen-5-yl)-1H-benzo[d]imidazol-2-yl)pyrrolidin-1-yl)-3-methyl-1-oxobutan-2-yl)carbamate bis(phosphate)
Emitasvir diphosphate
Methyl N-[(1S)-1-[[(2S)-2-[5-[6-[2-[(2S)-1-[(2S)-2-[(methoxycarbonyl)amino]-3-methyl-1-oxobutyl]-2-pyrrolidinyl]-1H-benzimidazol-6-yl]-2-naphthalenyl]-1H-imidazol-2-yl]-1-pyrrolidinyl]carbonyl]-2-methylpropyl]carbamate dihydrochloride