Hydrochloric Acid → {4-[4-(2,4-Dichloro-phenyl)-thiazol-2-yl]-piperazin-1-yl}-(2-isopropoxy-5-methanesulfonyl-phenyl)-methanone
Reaction equation
[CH:1]([CH3:2])([CH3:3])[O:4][c:5]1[c:6]([C:7](=[O:8])[OH:9])[cH:10][c:11]([S:14](=[O:15])(=[O:16])[CH3:17])[cH:12][cH:13]1.[Cl:20][c:21]1[c:22](-[c:28]2[n:29][c:30]([N:33]3[CH2:34][CH2:35][NH:36][CH2:37][CH2:38]3)[s:31][cH:32]2)[cH:23][cH:24][c:25]([Cl:27])[cH:26]1.[ClH:18].[ClH:19]>>[CH:1]([CH3:2])([CH3:3])[O:4][c:5]1[c:6]([C:7](=[O:9])[N:36]2[CH2:35][CH2:34][N:33]([c:30]3[n:29][c:28](-[c:22]4[c:21]([Cl:20])[cH:26][c:25]([Cl:27])[cH:24][cH:23]4)[cH:32][s:31]3)[CH2:38][CH2:37]2)[cH:10][c:11]([S:14](=[O:15])(=[O:16])[CH3:17])[cH:12][cH:13]1Participants
4
Sources & evidence
- ORD record
- ord-df2a6ef263544a7794402b5585015a34
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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