Account Rel-N-(4-((4-(cyanoethynyl)phenyl)amino)-4-oxobutyl)-5-((3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanamide
- Catalog No. :
- ACSJKH547
- CAS No. :
- 2170240-97-6
- Molecular Formula :
- C23H27N5O3S
- Molecular Weight :
- 453.57
IUPAC Name:N-(4-((4-(cyanoethynyl)phenyl)amino)-4-oxobutyl)-5-((3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanamide
![Rel-N-(4-((4-(cyanoethynyl)phenyl)amino)-4-oxobutyl)-5-((3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanamide structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | Rel-N-(4-((4-(cyanoethynyl)phenyl)amino)-4-oxobutyl)-5-((3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanamide |
|---|---|
| IUPAC Name | N-(4-((4-(cyanoethynyl)phenyl)amino)-4-oxobutyl)-5-((3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanamide |
| Molecular Formula | C23H27N5O3S |
| Molecular Weight | 453.57 |
| SMILES | O=C(NCCCC(NC1=CC=C(C#CC#N)C=C1)=O)CCCC[C@@H]2SC[C@]([C@]2([H])N3)([H])NC3=O |
| InChI Key | IBQNQQRHZDWGOS-IPJJNNNSSA-N |
| Synonym | APN-C3-biotin;1H-Thieno[3,4-d]imidazole-4-pentanamide, N-[4-[[4-(2-cyanoethynyl)phenyl]amino]-4-oxobutyl]hexahydro-2-oxo-, (3aR,4R,6aS)-rel- |
| CAS No. | 2170240-97-6 |
Synthetic Route by SureRoute
2. ACSJKH547 Molecular Building Block Synthetic Route
4-(5-((3AS,4S,6aR)-2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanamido)benzoic acid
Sodium 4-(5-((3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanamido)benzoate
N-(4-Hydroxyphenyl)-5-((3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanamide