Hydrochloric Acid → (2-Isobutoxy-5-methanesulfonyl-phenyl)-(4-quinolin-3-yl-piperazin-1-yl)-methanone
Reaction equation
[CH2:18]([CH:19]([CH3:20])[CH3:21])[O:22][c:23]1[c:24]([C:25](=[O:26])[OH:27])[cH:28][c:29]([S:32](=[O:33])(=[O:34])[CH3:35])[cH:30][cH:31]1.[CH3:36][CH2:37][O:38][C:39](=[O:40])[CH3:41].[CH3:42][C:43]#[N:44].[ClH:1].[N:2]1([c:8]2[cH:9][n:10][c:11]3[cH:12][cH:13][cH:14][cH:15][c:16]3[cH:17]2)[CH2:3][CH2:4][NH:5][CH2:6][CH2:7]1>>[N:2]1([c:8]2[cH:9][n:10][c:11]3[cH:12][cH:13][cH:14][cH:15][c:16]3[cH:17]2)[CH2:3][CH2:4][N:5]([C:25]([c:24]2[c:23]([O:22][CH2:18][CH:19]([CH3:20])[CH3:21])[cH:31][cH:30][c:29]([S:32](=[O:33])(=[O:34])[CH3:35])[cH:28]2)=[O:26])[CH2:6][CH2:7]1Participants
6
Sources & evidence
- ORD record
- ord-79c25524e71a42a6b8d8c501bec2d306
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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