Hydrochloric Acid → N-[5-(3,5-difluoro-benzenesulfonyl)-1H-indazol-3-yl]-4-(4-methyl-piperazin-1-yl)-2-[(tetrahydro-pyran-4-yl)-(2,2,2-trifluoro-acetyl)-amino]-benzamide
Reaction equation
[CH2:70]1[O:71][CH2:72][CH2:73][O:74][CH2:75]1.[CH3:76][OH:77].[ClH:69].[F:1][c:2]1[cH:3][c:4]([S:9](=[O:10])(=[O:11])[c:12]2[cH:13][c:14]3[c:15]([NH:40][C:41]([c:42]4[c:43]([N:55]([C:56]([C:57]([F:58])([F:59])[F:60])=[O:61])[CH:62]5[CH2:63][CH2:64][O:65][CH2:66][CH2:67]5)[cH:44][c:45]([N:48]5[CH2:49][CH2:50][N:51]([CH3:54])[CH2:52][CH2:53]5)[cH:46][cH:47]4)=[O:68])[n:16][n:17]([C:21]([c:22]4[cH:23][cH:24][cH:25][cH:26][cH:27]4)([c:28]4[cH:29][cH:30][cH:31][cH:32][cH:33]4)[c:34]4[cH:35][cH:36][cH:37][cH:38][cH:39]4)[c:18]3[cH:19][cH:20]2)[cH:5][c:6]([F:8])[cH:7]1>>[F:1][c:2]1[cH:3][c:4]([S:9](=[O:10])(=[O:11])[c:12]2[cH:13][c:14]3[c:15]([NH:40][C:41]([c:42]4[c:43]([N:55]([C:56]([C:57]([F:58])([F:59])[F:60])=[O:61])[CH:62]5[CH2:63][CH2:64][O:65][CH2:66][CH2:67]5)[cH:44][c:45]([N:48]5[CH2:49][CH2:50][N:51]([CH3:54])[CH2:52][CH2:53]5)[cH:46][cH:47]4)=[O:68])[n:16][nH:17][c:18]3[cH:19][cH:20]2)[cH:5][c:6]([F:8])[cH:7]1Participants
5
Reactant 4
Product 1
Sources & evidence
- ORD record
- ord-0115de8755b54760963bc39b5b2c9ae2
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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