Acetic Acid → 1-Acetyl-4-[(4-{[4-(4-aminophenyl)pyrimidin-2-yl}amino}phenyl)carbonyl}piperazine
Reaction equation
[C:1]([CH3:2])(=[O:3])[N:4]1[CH2:5][CH2:6][N:7]([C:10](=[O:11])[c:12]2[cH:13][cH:14][c:15]([NH:18][c:19]3[n:20][cH:21][cH:22][c:23](-[c:25]4[cH:26][cH:27][c:28]([N+:31]([O-:32])=[O:33])[cH:29][cH:30]4)[n:24]3)[cH:16][cH:17]2)[CH2:8][CH2:9]1.[CH3:34][C:35](=[O:36])[OH:37].[CH3:38][OH:39]>>[C:1]([CH3:2])(=[O:3])[N:4]1[CH2:5][CH2:6][N:7]([C:10](=[O:11])[c:12]2[cH:13][cH:14][c:15]([NH:18][c:19]3[n:20][cH:21][cH:22][c:23](-[c:25]4[cH:26][cH:27][c:28]([NH2:31])[cH:29][cH:30]4)[n:24]3)[cH:16][cH:17]2)[CH2:8][CH2:9]1Participants
4
Sources & evidence
- ORD record
- ord-4defb1c38dae4f4bb8c122281acd5010
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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