Dimethylformamide → 4-Benzyl-4-({2-cyano-4-[(spiro[2.5]oct-6-ylmethyl)-amino]-pyrimidine-5-carbonyl}amino)piperidine-1-carboxylic acid tert-butyl ester
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][C:11]([CH2:14][c:15]2[cH:16][cH:17][cH:18][cH:19][cH:20]2)([NH2:21])[CH2:12][CH2:13]1.[C:22](#[N:23])[c:24]1[n:25][cH:26][c:27]([C:40](=[O:41])[OH:42])[c:28]([NH:30][CH2:31][CH:32]2[CH2:33][CH2:34][C:35]3([CH2:36][CH2:37]3)[CH2:38][CH2:39]2)[n:29]1.[CH3:58][CH2:59][O:60][C:61]([CH3:62])=[O:63].[O:53]=[CH:54][N:55]([CH3:56])[CH3:57].[OH:43][n:44]1[c:45]2[n:46][cH:47][cH:48][cH:49][c:50]2[n:51][n:52]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][C:11]([CH2:14][c:15]2[cH:16][cH:17][cH:18][cH:19][cH:20]2)([NH:21][C:40]([c:27]2[cH:26][n:25][c:24]([C:22]#[N:23])[n:29][c:28]2[NH:30][CH2:31][CH:32]2[CH2:33][CH2:34][C:35]3([CH2:36][CH2:37]3)[CH2:38][CH2:39]2)=[O:41])[CH2:12][CH2:13]1Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-a5d651b85ea341d39a249198ff6d066a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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