Ethyl Acetate → 2-Amino-5-(4-methyl-1-piperazinyl)benzonitrile
Reaction equation
[CH3:19][CH2:20][O:21][C:22]([CH3:23])=[O:24].[CH3:1][N:2]1[CH2:3][CH2:4][N:5]([c:8]2[cH:9][cH:10][c:11]([N+:16]([O-:17])=[O:18])[c:12]([C:14]#[N:15])[cH:13]2)[CH2:6][CH2:7]1>>[CH3:1][N:2]1[CH2:3][CH2:4][N:5]([c:8]2[cH:9][cH:10][c:11]([NH2:16])[c:12]([C:14]#[N:15])[cH:13]2)[CH2:6][CH2:7]1Participants
3
Sources & evidence
- ORD record
- ord-4497b2fa8a1f45ab86e48e33a7b22100
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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