Acetate → 2-chloro-N-[6-chloro-7-(4-methyl-piperazin-1-yl)-9H-beta-carbolin-8-yl]-nicotinamide
Reaction equation
[CH3:34][C:35](=[O:36])[O-:37].[Cl:1][c:2]1[cH:3][c:4]2[c:5]3[cH:6][cH:7][n:8][cH:9][c:10]3[nH:11][c:12]2[c:13]([NH2:22])[c:14]1[N:15]1[CH2:16][CH2:17][N:18]([CH3:21])[CH2:19][CH2:20]1.[Cl:23][c:24]1[c:25]([C:26](=[O:27])[OH:28])[cH:29][cH:30][cH:31][n:32]1.[NH4+:33]>>[Cl:1][c:2]1[cH:3][c:4]2[c:5]3[cH:6][cH:7][n:8][cH:9][c:10]3[nH:11][c:12]2[c:13]([NH:22][C:26]([c:25]2[c:24]([Cl:23])[n:32][cH:31][cH:30][cH:29]2)=[O:27])[c:14]1[N:15]1[CH2:16][CH2:17][N:18]([CH3:21])[CH2:19][CH2:20]1Participants
5
Sources & evidence
- ORD record
- ord-06b3079e45a8418f9206ff59ce3e1951
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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