Acetyl chloride → 1-[1-(1-methoxycarbonylazetidin-3-yl)-piperidin-4-yl]-3-(methylsulfonyl)-1,3-dihydro-2H-benzimidazol-2-one
Reaction equation
[CH3:1][O:2][C:3]([N:4]1[CH2:5][CH2:6][CH:7]([N:8]2[CH2:9][CH2:10][CH:11]([n:12]3[c:13]4[cH:14][cH:15][cH:16][cH:17][c:18]4[nH:19][c:20]3=[O:21])[CH2:22][CH2:23]2)[CH2:24][CH2:25]1)=[O:26].[CH3:27][O:28][C:29](=[O:30])[N:31]1[CH2:32][CH:33]([N:35]2[CH2:36][CH2:37][CH:38]([n:41]3[c:42](=[O:50])[nH:43][c:44]4[c:45]3[cH:46][cH:47][cH:48][cH:49]4)[CH2:39][CH2:40]2)[CH2:34]1.[CH3:51][C:52](=[O:53])[Cl:54].[CH3:55][S:56]([Cl:57])(=[O:58])=[O:59]>>[CH3:27][O:28][C:29](=[O:30])[N:31]1[CH2:32][CH:33]([N:35]2[CH2:36][CH2:37][CH:38]([n:41]3[c:42](=[O:50])[n:43]([S:56]([CH3:55])(=[O:58])=[O:59])[c:44]4[c:45]3[cH:46][cH:47][cH:48][cH:49]4)[CH2:39][CH2:40]2)[CH2:34]1Participants
5
Reactant 4
Product 1
Sources & evidence
- ORD record
- ord-09c8db86ae8c44bca8642f78b0d80f2d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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