Hydrochloric Acid → 2-[2-(1H-indazol-3-yl)ethenyl]-5-(4-methylsulfonylpiperazin-1-yl)aniline
Reaction equation
[CH3:1][S:2](=[O:3])(=[O:4])[N:5]1[CH2:6][CH2:7][N:8]([c:11]2[cH:12][c:13]([N+:28]([O-:29])=[O:30])[c:14]([CH:17]=[CH:18][c:19]3[n:20][nH:21][c:22]4[cH:23][cH:24][cH:25][cH:26][c:27]34)[cH:15][cH:16]2)[CH2:9][CH2:10]1.[CH3:35][CH2:36][OH:37].[ClH:32].[Na+:34].[OH-:33].[Sn:31]>>[CH3:1][S:2](=[O:3])(=[O:4])[N:5]1[CH2:6][CH2:7][N:8]([c:11]2[cH:12][c:13]([NH2:28])[c:14]([CH:17]=[CH:18][c:19]3[n:20][nH:21][c:22]4[cH:23][cH:24][cH:25][cH:26][c:27]34)[cH:15][cH:16]2)[CH2:9][CH2:10]1Participants
7
Sources & evidence
- ORD record
- ord-9e4e2def05834887a67e0278480d9e3b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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