![Chemical structure of 2-Chloro-9-cyclopentyl-7,7-difluoro-8,9-dihydro-5H-pyrimido[4,5-b][1,4]diazepin-6(7H)-one, CAS 1062246-01-8](https://api.angenesci.com/structure/1666/1062246-01-8.png)
| CAS Number | 1062246-01-8 |
| Catalog Number | AG00HASK |
| Chemical Name | 2-Chloro-9-cyclopentyl-7,7-difluoro-8,9-dihydro-5H-pyrimido[4,5-b][1,4]diazepin-6(7H)-one |
| IUPAC Name | 2-chloro-9-cyclopentyl-7,7-difluoro-5,8-dihydropyrimido[4,5-b][1,4]diazepin-6-one |
| InChI | InChI=1S/C12H13ClF2N4O/c13-11-16-5-8-9(18-11)19(7-3-1-2-4-7)6-12(14,15)10(20)17-8/h5,7H,1-4,6H2,(H,17,20) |
| InChI Key | QUCPBKFOMWSJFG-UHFFFAOYSA-N |
| MDL Number | MFCD25542099 |
| Molecular Formula | C12H13ClF2N4O |
| Molecular Weight | 302.7076 |
| SMILES | ClC=1N=CC2=C(N(CC(C(N2)=O)(F)F)C2CCCC2)N1 |
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