2-Mercaptobenzoic Acid → 4-Isopropyl-N-(6-piperazin-1-ylpyridin-3-yl)benzenesulfonamide
Reaction equation
[CH2:31]([CH:32]=[CH2:33])[N:34]1[CH2:35][CH2:36][N:37]([c:40]2[cH:41][cH:42][c:43]([NH:46][S:47](=[O:48])(=[O:49])[c:50]3[cH:51][cH:52][c:53]([CH:56]([CH3:57])[CH3:58])[cH:54][cH:55]3)[cH:44][n:45]2)[CH2:38][CH2:39]1.[O:69]1[CH2:70][CH2:71][CH2:72][CH2:73]1.[SH:59][c:60]1[cH:61][cH:62][cH:63][cH:64][c:65]1[C:66]([OH:67])=[O:68].[c:1]1([P:2]([c:3]2[cH:4][cH:5][cH:6][cH:7][cH:8]2)[CH2:9][CH2:10][CH2:11][CH2:12][P:13]([c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)[c:20]2[cH:21][cH:22][cH:23][cH:24][cH:25]2)[cH:26][cH:27][cH:28][cH:29][cH:30]1>>[NH:34]1[CH2:35][CH2:36][N:37]([c:40]2[cH:41][cH:42][c:43]([NH:46][S:47](=[O:48])(=[O:49])[c:50]3[cH:51][cH:52][c:53]([CH:56]([CH3:57])[CH3:58])[cH:54][cH:55]3)[cH:44][n:45]2)[CH2:38][CH2:39]1Participants
5
Sources & evidence
- ORD record
- ord-d006104a16fc439197cb56f9479325a4
- Source dataset
- Test data from https://doi.org/10.1039/C8SC04228D
Reaction notes
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