Account tert-Butyl 2-benzyl-4-oxo-5,6,8,9-tetrahydro-3H-pyrimido[4,5-d]azepine-7(4H)-carboxylate
- Catalog No. :
- ACAEMW901
- CAS No. :
- 1023953-97-0
- Molecular Formula :
- C20H25N3O3
- Molecular Weight :
- 355.44
IUPAC Name:tert-butyl 2-benzyl-4-oxo-3,4,5,6,8,9-hexahydro-7H-pyrimido[4,5-d]azepine-7-carboxylate
![tert-Butyl 2-benzyl-4-oxo-5,6,8,9-tetrahydro-3H-pyrimido[4,5-d]azepine-7(4H)-carboxylate structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | tert-Butyl 2-benzyl-4-oxo-5,6,8,9-tetrahydro-3H-pyrimido[4,5-d]azepine-7(4H)-carboxylate |
|---|---|
| IUPAC Name | tert-butyl 2-benzyl-4-oxo-3,4,5,6,8,9-hexahydro-7H-pyrimido[4,5-d]azepine-7-carboxylate |
| MDL No. | MFCD28502600 |
| Molecular Formula | C20H25N3O3 |
| Molecular Weight | 355.44 |
| SMILES | O=C(N1CCC(N=C(CC2=CC=CC=C2)NC3=O)=C3CC1)OC(C)(C)C |
| InChI Key | INKLWRKQPCPMNH-UHFFFAOYSA-N |
| Synonym | TERT-BUTYL 2-BENZYL-4-OXO-5,6,8,9-TETRAHYDRO-3H-PYRIMIDO[4,5-D]AZEPINE-7(4H)-CARBOXYLATE;tert-Butyl 2-benzyl-4-oxo-3H,4H,5H,6H,7H,8H,9H-pyrimido[4,5-d]azepine-7-carboxylate;7H-Pyrimido[4,5-d]azepine-7-carboxylic acid, 3,4,5,6,8,9-hexahydro-4-oxo-2-(phenylmethyl)-, 1,1-dimethylethyl ester |
| CAS No. | 1023953-97-0 |
Safety Data
- Pictogram
- Signal Word
- Achtung
- Hazard Statement(s)
- H302-H315-H319-H335
- Precautionary Statement(s)
- P261-P280-P301+P312-P302+P352-P305+P351+P338
Synthetic Route by SureRoute
2. ACAEMW901 Molecular Building Block Synthetic Route
tert-Butyl 4-oxo-2-thioxo-1,2,3,4,5,6,8,9-octahydro-7H-pyrimido[4,5-d]azepine-7-carboxylate
Benzyl 4-oxo-5,6,8,9-tetrahydro-3H-pyrimido[4,5-d]azepine-7(4H)-carboxylate
2-Methyl-6,7,8,9-tetrahydro-1H-pyrimido[4,5-d]azepin-4(5H)-one