Ethyl Acetate → 3-[4-(5-amino-1-benzenesulfonyl-1H-pyrrolo[2,3-b]pyridin-4-ylamino)-piperidin-1-yl]-butyronitrile
Reaction equation
[CH3:34][CH2:35][O:36][C:37]([CH3:38])=[O:39].[c:1]1([S:7](=[O:8])(=[O:9])[n:10]2[cH:11][cH:12][c:13]3[c:14]2[n:15][cH:16][c:17]([N+:31]([O-:32])=[O:33])[c:18]3[NH:19][CH:20]2[CH2:21][CH2:22][N:23]([CH:26]([CH2:27][C:28]#[N:29])[CH3:30])[CH2:24][CH2:25]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([S:7](=[O:8])(=[O:9])[n:10]2[cH:11][cH:12][c:13]3[c:14]2[n:15][cH:16][c:17]([NH2:31])[c:18]3[NH:19][CH:20]2[CH2:21][CH2:22][N:23]([CH:26]([CH2:27][C:28]#[N:29])[CH3:30])[CH2:24][CH2:25]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1Participants
3
Sources & evidence
- ORD record
- ord-beb4b2f9058647d18862c0519e529ce6
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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