Water → Methanesulfonic acid 7,9-difluoro-5-[4-(2-piperidin-1-yl-ethoxy)-phenyl]-5H-6-thia-chrysen-2-yl ester
Reaction equation
[CH2:56]([Cl:57])[Cl:58].[CH3:43][CH2:44][N:45]([CH2:46][CH3:47])[CH2:48][CH3:49].[CH3:50][S:51](=[O:52])(=[O:53])[Cl:54].[F:1][c:2]1[c:3]([S:41][CH3:40])[c:4](-[c:9]2[c:10]([CH:24]([c:25]3[cH:26][cH:27][c:28]([O:31][CH2:32][CH2:33][N:34]4[CH2:35][CH2:36][CH2:37][CH2:38][CH2:39]4)[cH:29][cH:30]3)[OH:42])[c:11]3[cH:12][cH:13][c:14]([O:19][S:20](=[O:21])(=[O:22])[CH3:23])[cH:15][c:16]3[cH:17][cH:18]2)[cH:5][c:6]([F:8])[cH:7]1.[OH2:55]>>[F:1][c:2]1[c:3]2[c:4]([cH:5][c:6]([F:8])[cH:7]1)-[c:9]1[c:10]([c:11]3[cH:12][cH:13][c:14]([O:19][S:20](=[O:21])(=[O:22])[CH3:23])[cH:15][c:16]3[cH:17][cH:18]1)[CH:24]([c:25]1[cH:26][cH:27][c:28]([O:31][CH2:32][CH2:33][N:34]3[CH2:35][CH2:36][CH2:37][CH2:38][CH2:39]3)[cH:29][cH:30]1)[S:41]2Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-3282bec13083415193fcfdbdd6b46a28
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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