Acetonitrile → 4-{4-[(4-Cyano-1H-pyrrole-2-carbonyl)-amino]-3-cyclohex-1-enyl-phenyl]-piperidine-1-carboxylic acid tert-butyl ester
Reaction equation
[C:19]([CH3:20])([CH3:21])([CH3:22])[O:23][C:24](=[O:25])[N:26]1[CH2:27][CH2:28][CH:29]([c:32]2[cH:33][c:34]([C:39]3=[CH:40][CH2:41][CH2:42][CH2:43][CH2:44]3)[c:35]([NH2:38])[cH:36][cH:37]2)[CH2:30][CH2:31]1.[C:1](#[N:2])[c:3]1[cH:4][c:5]([C:8](=[O:9])[OH:10])[nH:6][cH:7]1.[CH3:45][C:46]#[N:47].[Cl:11][C:12]([N:13]([CH3:14])[CH3:15])=[C:16]([CH3:17])[CH3:18]>>[C:1](#[N:2])[c:3]1[cH:4][c:5]([C:8](=[O:10])[NH:38][c:35]2[c:34]([C:39]3=[CH:40][CH2:41][CH2:42][CH2:43][CH2:44]3)[cH:33][c:32]([CH:29]3[CH2:28][CH2:27][N:26]([C:24]([O:23][C:19]([CH3:20])([CH3:21])[CH3:22])=[O:25])[CH2:31][CH2:30]3)[cH:37][cH:36]2)[nH:6][cH:7]1Participants
5
Reactant 4
Product 1
Sources & evidence
- ORD record
- ord-c4424b95308a4f038d704bddb46a4920
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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