1,2-Dichloroethane → 6-Chloro-2-(4-(4-methylpiperazine-1-carbonyl)phenylamino)nicotinamide
Reaction equation
[C:1]([NH2:2])(=[O:3])[c:4]1[c:5]([NH:11][c:12]2[cH:13][cH:14][c:15]([C:16](=[O:17])[OH:18])[cH:19][cH:20]2)[n:6][c:7]([Cl:10])[cH:8][cH:9]1.[CH2:38]([Cl:39])[CH2:40][Cl:41].[CH3:21][N:22]1[CH2:23][CH2:24][NH:25][CH2:26][CH2:27]1.[O:42]=[CH:43][N:44]([CH3:45])[CH3:46].[OH2:47].[OH:28][n:29]1[c:30]2[c:31]([cH:32][cH:33][cH:34][cH:35]2)[n:36][n:37]1>>[C:1]([NH2:2])(=[O:3])[c:4]1[c:5]([NH:11][c:12]2[cH:13][cH:14][c:15]([C:16](=[O:18])[N:25]3[CH2:24][CH2:23][N:22]([CH3:21])[CH2:27][CH2:26]3)[cH:19][cH:20]2)[n:6][c:7]([Cl:10])[cH:8][cH:9]1Participants
7
Sources & evidence
- ORD record
- ord-649a652d2ed44e86b823c4099642d840
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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