Chloride → tert-Butyl 4-chloro-5,6,7,9-tetrahydro-8H-pyrimido[5',4':4,5]thieno[2,3-c]azepine-8-carboxylate
Reaction equation
[CH3:37][c:38]1[cH:39][cH:40][cH:41][cH:42][cH:43]1.[CH3:44][CH2:45][N:46]([CH2:47][CH3:48])[CH2:49][CH3:50].[Cl-:36].[Na+:35].[O:13]=[c:14]1[nH:15][cH:16][n:17][c:18]2[c:19]1[c:20]1[c:21]([s:34]2)[CH2:22][N:23]([C:27](=[O:28])[O:29][C:30]([CH3:31])([CH3:32])[CH3:33])[CH2:24][CH2:25][CH2:26]1.[P:8]([Cl:9])([Cl:10])([Cl:11])=[O:12].[S:1]1(=[O:6])(=[O:7])[CH2:2][CH2:3][CH2:4][CH2:5]1>>[c:14]1([Cl:36])[n:15][cH:16][n:17][c:18]2[c:19]1[c:20]1[c:21]([s:34]2)[CH2:22][N:23]([C:27](=[O:28])[O:29][C:30]([CH3:31])([CH3:32])[CH3:33])[CH2:24][CH2:25][CH2:26]1Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-d738ffa7ee74485abf735291c1e8cc44
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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