Isobutyryl chloride → 2-Chloro-N-isobutyryl-5-[(4-{2-[3-(2-methyl-1H-benzimidazol-1-yl)-8-azabicyclo[3.2.1]oct-8-yl]ethyl}-4-phenylpiperidin-1-yl)carbonyl]benzene-sulfonamide
Reaction equation
[C:46]([CH:47]([CH3:48])[CH3:49])(=[O:50])[Cl:51].[Cl:1][c:2]1[c:3]([S:42](=[O:43])(=[O:44])[NH2:45])[cH:4][c:5]([C:8](=[O:9])[N:10]2[CH2:11][CH2:12][C:13]([c:16]3[cH:17][cH:18][cH:19][cH:20][cH:21]3)([CH2:22][CH2:23][N:24]3[CH:25]4[CH2:26][CH:27]([n:32]5[c:33]([CH3:41])[n:34][c:35]6[c:36]5[cH:37][cH:38][cH:39][cH:40]6)[CH2:28][CH:29]3[CH2:30][CH2:31]4)[CH2:14][CH2:15]2)[cH:6][cH:7]1>>[Cl:1][c:2]1[c:3]([S:42](=[O:43])(=[O:44])[NH:45][C:46]([CH:47]([CH3:48])[CH3:49])=[O:50])[cH:4][c:5]([C:8](=[O:9])[N:10]2[CH2:11][CH2:12][C:13]([c:16]3[cH:17][cH:18][cH:19][cH:20][cH:21]3)([CH2:22][CH2:23][N:24]3[CH:25]4[CH2:26][CH:27]([n:32]5[c:33]([CH3:41])[n:34][c:35]6[c:36]5[cH:37][cH:38][cH:39][cH:40]6)[CH2:28][CH:29]3[CH2:30][CH2:31]4)[CH2:14][CH2:15]2)[cH:6][cH:7]1Participants
3
Reactant 2
Product 1
Sources & evidence
- ORD record
- ord-a59613bde81b49809e992b90b64818d2
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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