N-methyl-2-pyrrolidone → 4-({3-chloro-4-[(1-methyl-1H-imidazole-2-yl)thio]phenyl}amino)-7-{4-[2-(1H-imidazole-1-yl)ethyl]piperazin-1-yl}-6-methoxyquinoline-3-carbonitrile
Reaction equation
[CH3:44][N:45]1[CH2:46][CH2:47][CH2:48][C:49]1=[O:50].[Cl:1][c:2]1[cH:3][c:4]([NH:15][c:16]2[c:17]([C:29]#[N:30])[cH:18][n:19][c:20]3[cH:21][c:22]([F:28])[c:23]([O:26][CH3:27])[cH:24][c:25]23)[cH:5][cH:6][c:7]1[S:8][c:9]1[n:10]([CH3:14])[cH:11][cH:12][n:13]1.[n:31]1([CH2:36][CH2:37][N:38]2[CH2:39][CH2:40][NH:41][CH2:42][CH2:43]2)[cH:32][n:33][cH:34][cH:35]1>>[Cl:1][c:2]1[cH:3][c:4]([NH:15][c:16]2[c:17]([C:29]#[N:30])[cH:18][n:19][c:20]3[cH:21][c:22]([N:41]4[CH2:40][CH2:39][N:38]([CH2:37][CH2:36][n:31]5[cH:32][n:33][cH:34][cH:35]5)[CH2:43][CH2:42]4)[c:23]([O:26][CH3:27])[cH:24][c:25]23)[cH:5][cH:6][c:7]1[S:8][c:9]1[n:10]([CH3:14])[cH:11][cH:12][n:13]1Participants
4
Reactant 3
Product 1
Sources & evidence
- ORD record
- ord-de1b329cdd8f45e98d878f086dc39e25
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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