Account 3-Chloro-N-(trans-4-(methylamino)cyclohexyl)-N-(3-(pyridin-4-yl)benzyl)benzo[b]thiophene-2-carboxamide
- Catalog No. :
- ACWARV925
- CAS No. :
- 912545-86-9
- Molecular Formula :
- C28H28ClN3OS
- Molecular Weight :
- 490.07
IUPAC Name:3-chloro-N-((1r,4r)-4-(methylamino)cyclohexyl)-N-(3-(pyridin-4-yl)benzyl)benzo[b]thiophene-2-carboxamide
![3-Chloro-N-(trans-4-(methylamino)cyclohexyl)-N-(3-(pyridin-4-yl)benzyl)benzo[b]thiophene-2-carboxamide structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | 3-Chloro-N-(trans-4-(methylamino)cyclohexyl)-N-(3-(pyridin-4-yl)benzyl)benzo[b]thiophene-2-carboxamide |
|---|---|
| IUPAC Name | 3-chloro-N-((1r,4r)-4-(methylamino)cyclohexyl)-N-(3-(pyridin-4-yl)benzyl)benzo[b]thiophene-2-carboxamide |
| MDL No. | MFCD22581513 |
| Molecular Formula | C28H28ClN3OS |
| Molecular Weight | 490.07 |
| SMILES | CN[C@H]1CC[C@H](N(CC2=CC=CC(C3=CC=NC=C3)=C2)C(=O)C2=C(Cl)C3=CC=CC=C3S2)CC1 |
| InChI Key | VFSUUTYAEQOIMW-YHBQERECSA-N |
| Synonym | 912545-86-9 | SAG | smoothened agonist | sag (smo-agonist) | Sag (smo agonist) | SAG (Smo agonist) free base | (Rac)-SAG | SAG dihydrochloride | 4XN97SZK4J | Sag (cyclopamine antagonist) | 3-chloro-N-((1r,4r)-4-(methylamino)cyclohexyl)-N-(3-(pyridin-4-yl)benzyl)benzo[b]thiop |
| CAS No. | 912545-86-9 |
| PubChem CID | 5284330 |
Safety Data
- Pictogram
- Signal Word
- Warning
- Hazard Statement(s)
- H302-H315-H319-H335
- Precautionary Statement(s)
- P261-P305+P351+P338
Synthetic Route by SureRoute
2. ACWARV925 Molecular Building Block Synthetic Route
rel-3-Chloro-N-((1r,4r)-4-(methylamino)cyclohexyl)-N-(3-(pyridin-4-yl)benzyl)benzo[b]thiophene-2-carboxamide hydrochloride
3-Chloro-N-(trans-4-(methylamino)cyclohexyl)-N-(3-(pyridin-4-yl)benzyl)benzo[b]thiophene-2-carboxamide dihydrochloride
(Rac)-SAG