Acetone → 1-[(4-fluorophenyl)methyl]-N-[1-[2-(2-pyrimidinylthio)ethyl]-4-piperidinyl]-1H-benzimidazol-2-amine
Reaction equation
[C:37](=[O:38])([O-:39])[O-:40].[CH3:43][C:44](=[O:45])[CH3:46].[Cl:10][CH2:11][CH2:12][N:13]1[CH2:14][CH2:15][CH:16]([NH:19][c:20]2[n:21][c:22]3[c:23]([n:24]2[CH2:25][c:26]2[cH:27][cH:28][c:29]([F:32])[cH:30][cH:31]2)[cH:33][cH:34][cH:35][cH:36]3)[CH2:17][CH2:18]1.[ClH:8].[ClH:9].[K+:41].[K+:42].[n:1]1[c:2]([SH:7])[n:3][cH:4][cH:5][cH:6]1>>[n:1]1[c:2]([S:7][CH2:11][CH2:12][N:13]2[CH2:14][CH2:15][CH:16]([NH:19][c:20]3[n:21][c:22]4[c:23]([n:24]3[CH2:25][c:26]3[cH:27][cH:28][c:29]([F:32])[cH:30][cH:31]3)[cH:33][cH:34][cH:35][cH:36]4)[CH2:17][CH2:18]2)[n:3][cH:4][cH:5][cH:6]1Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-b8aca34528be4c64b8f33f9eb086bf7b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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