Account Propan-2-yl 4-({3-cyano-5H,6H,7H,8H,9H-cyclohepta[b]pyridin-2-yl}sulfanyl)-3-oxobutanoate
- Catalog No. :
- ACKLLU974
- CAS No. :
- 488725-51-5
- Molecular Formula :
- C18H22N2O3S
- Molecular Weight :
- 346.45
IUPAC Name:isopropyl 4-((3-cyano-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-2-yl)thio)-3-oxobutanoate
![Propan-2-yl 4-({3-cyano-5H,6H,7H,8H,9H-cyclohepta[b]pyridin-2-yl}sulfanyl)-3-oxobutanoate structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | Propan-2-yl 4-({3-cyano-5H,6H,7H,8H,9H-cyclohepta[b]pyridin-2-yl}sulfanyl)-3-oxobutanoate |
|---|---|
| IUPAC Name | isopropyl 4-((3-cyano-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-2-yl)thio)-3-oxobutanoate |
| MDL No. | MFCD02950756 |
| Molecular Formula | C18H22N2O3S |
| Molecular Weight | 346.45 |
| SMILES | O=C(OC(C)C)CC(CSC1=C(C#N)C=C(CCCCC2)C2=N1)=O |
| InChI Key | KCAHKDBPSZBWQD-UHFFFAOYSA-N |
| Synonym | isopropyl 4-((3-cyano-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-2-yl)thio)-3-oxobutanoate;Butanoic acid, 4-[(3-cyano-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-2-yl)thio]-3-oxo-, 1-methylethyl ester |
| CAS No. | 488725-51-5 |
Safety Data
- Pictogram
- Signal Word
- Achtung
- Hazard Statement(s)
- H302-H315-H319-H335
- Precautionary Statement(s)
- P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P330-P362-P403+P233-P501
Synthetic Route by SureRoute
2. ACKLLU974 Molecular Building Block Synthetic Route
Propan-2-yl 4-({3-cyano-5H,6H,7H,8H,9H,10H-cycloocta[b]pyridin-2-yl}sulfanyl)-3-oxobutanoate
Methyl 4-({3-cyano-5H,6H,7H,8H,9H-cyclohepta[b]pyridin-2-yl}sulfanyl)-3-oxobutanoate
Propan-2-yl 2-({3-cyano-5H,6H,7H,8H,9H-cyclohepta[b]pyridin-2-yl}sulfanyl)acetate