1,2-Dichloroethane → 5-bromo-3-methyl-1-(toluene-4-sulfonyl)-1H-indazol-6-ylamine
Reaction equation
[Br-:24].[Br-:25].[Br-:26].[CH2:27]([N+:28]([CH2:29][CH2:30][CH2:31][CH3:32])([CH2:33][CH2:34][CH2:35][CH3:36])[CH2:37][CH2:38][CH2:39][CH3:40])[CH2:41][CH2:42][CH3:43].[CH2:44]([N+:45]([CH2:46][CH2:47][CH2:48][CH3:49])([CH2:50][CH2:51][CH2:52][CH3:53])[CH2:54][CH2:55][CH2:56][CH3:57])[CH2:58][CH2:59][CH3:60].[CH2:61]([N+:62]([CH2:63][CH2:64][CH2:65][CH3:66])([CH2:67][CH2:68][CH2:69][CH3:70])[CH2:71][CH2:72][CH2:73][CH3:74])[CH2:75][CH2:76][CH3:77].[CH3:1][c:2]1[n:3][n:4]([S:12](=[O:13])(=[O:14])[c:15]2[cH:16][cH:17][c:18]([CH3:21])[cH:19][cH:20]2)[c:5]2[cH:6][c:7]([NH2:11])[cH:8][cH:9][c:10]12.[CH3:22][OH:23].[Cl:78][CH2:79][CH2:80][Cl:81]>>[CH3:1][c:2]1[n:3][n:4]([S:12](=[O:13])(=[O:14])[c:15]2[cH:16][cH:17][c:18]([CH3:21])[cH:19][cH:20]2)[c:5]2[cH:6][c:7]([NH2:11])[c:8]([Br:24])[cH:9][c:10]12Participants
6
Sources & evidence
- ORD record
- ord-35fdecfc197544f9b86ce18ecf8de314
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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