Hydrochloric Acid → (2-Isopropoxy-5-methanesulfonyl-phenyl)-(4-quinoxalin-2-yl-piperazin-1-yl)-methanone
Reaction equation
[CH3:35][CH2:36][O:37][C:38](=[O:39])[CH3:40].[CH3:41][C:42]#[N:43].[CH:18]([CH3:19])([CH3:20])[O:21][c:22]1[c:23]([C:24](=[O:25])[OH:26])[cH:27][c:28]([S:31](=[O:32])(=[O:33])[CH3:34])[cH:29][cH:30]1.[ClH:1].[N:2]1([c:8]2[n:9][c:10]3[cH:11][cH:12][cH:13][cH:14][c:15]3[n:16][cH:17]2)[CH2:3][CH2:4][NH:5][CH2:6][CH2:7]1>>[N:2]1([c:8]2[n:9][c:10]3[cH:11][cH:12][cH:13][cH:14][c:15]3[n:16][cH:17]2)[CH2:3][CH2:4][N:5]([C:24]([c:23]2[c:22]([O:21][CH:18]([CH3:19])[CH3:20])[cH:30][cH:29][c:28]([S:31](=[O:32])(=[O:33])[CH3:34])[cH:27]2)=[O:25])[CH2:6][CH2:7]1Participants
6
Sources & evidence
- ORD record
- ord-3f9845b17a4249ec8e14cb6862310525
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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