HCID 58315415, compound → 4-[6-(6-cyano-7-cyclopentyl-7H-pyrrolo[2,3-d]pyrimidin-2-ylamino)-pyridin-3-yl]-2-methyl-piperazine-1-carboxylic acid tert-butyl ester
Reaction equation
[C:18]([CH3:19])([CH3:20])([CH3:21])[O:22][C:23](=[O:24])[N:25]1[CH:26]([CH3:38])[CH2:27][N:28]([c:31]2[cH:32][n:33][c:34]([NH2:37])[cH:35][cH:36]2)[CH2:29][CH2:30]1.[Cl:1][c:2]1[n:3][cH:4][c:5]2[c:6]([n:7]1)[n:8]([CH:13]1[CH2:14][CH2:15][CH2:16][CH2:17]1)[c:9]([C:11]#[N:12])[cH:10]2>>[c:2]1([NH:37][c:34]2[n:33][cH:32][c:31]([N:28]3[CH2:27][CH:26]([CH3:38])[N:25]([C:23]([O:22][C:18]([CH3:19])([CH3:20])[CH3:21])=[O:24])[CH2:30][CH2:29]3)[cH:36][cH:35]2)[n:3][cH:4][c:5]2[c:6]([n:7]1)[n:8]([CH:13]1[CH2:14][CH2:15][CH2:16][CH2:17]1)[c:9]([C:11]#[N:12])[cH:10]2Participants
3
Sources & evidence
- ORD record
- ord-cb712ef219274e729b1886aaafd24cda
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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