1,2-Dichloroethane → tert-butyl 3-[[2-tert-butyl-4-(3-methoxypropylamino)pyrimidine-5-carbonyl]-(2-methylpropyl)amino]-5-(3,4-dihydro-1H-isoquinoline-2-carbonyl)piperidine-1-carboxylate
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH:10]([C:37](=[O:38])[OH:39])[CH2:11][CH:12]([N:14]([CH2:15][CH:16]([CH3:17])[CH3:18])[C:19](=[O:20])[c:21]2[c:22]([NH:31][CH2:32][CH2:33][CH2:34][O:35][CH3:36])[n:23][c:24]([C:27]([CH3:28])([CH3:29])[CH3:30])[n:25][cH:26]2)[CH2:13]1.[CH2:40]1[NH:41][CH2:42][CH2:43][c:44]2[cH:45][cH:46][cH:47][cH:48][c:49]21.[CH3:60][CH2:61][N:62]([CH2:63][CH3:64])[CH2:65][CH3:66].[Cl:67][CH2:68][CH2:69][Cl:70].[OH:50][n:51]1[c:52]2[c:53]([cH:54][cH:55][cH:56][cH:57]2)[n:58][n:59]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH:10]([C:37](=[O:38])[N:41]2[CH2:40][c:49]3[c:44]([cH:45][cH:46][cH:47][cH:48]3)[CH2:43][CH2:42]2)[CH2:11][CH:12]([N:14]([CH2:15][CH:16]([CH3:17])[CH3:18])[C:19](=[O:20])[c:21]2[c:22]([NH:31][CH2:32][CH2:33][CH2:34][O:35][CH3:36])[n:23][c:24]([C:27]([CH3:28])([CH3:29])[CH3:30])[n:25][cH:26]2)[CH2:13]1Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-2e48573423aa45eda5319c8ab1a777d3
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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