Sodium ion → 4-(4-chloro-benzenesulfonyl)-6-methyl-8-piperazin-1-yl-3,4-dihydro-2H-benzo[1,4]oxazine
Reaction equation
[Br:53][c:54]1[cH:55][c:56]([CH3:74])[cH:57][c:58]2[c:63]1[O:62][CH2:61][CH2:60][N:59]2[S:64](=[O:65])(=[O:66])[c:67]1[cH:68][cH:69][c:70]([Cl:73])[cH:71][cH:72]1.[CH2:75]1[CH2:76][NH:77][CH2:78][CH2:79][NH:80]1.[CH3:47][C:48]([CH3:49])([O-:50])[CH3:51].[CH3:81][c:82]1[cH:83][cH:84][cH:85][cH:86][cH:87]1.[CH3:88][CH2:89][O:90][C:91](=[O:92])[CH3:93].[Na+:52].[O:114]=[C:115]([CH:116]=[CH:117][c:118]1[cH:119][cH:120][cH:121][cH:122][cH:123]1)[CH:124]=[CH:125][c:126]1[cH:127][cH:128][cH:129][cH:130][cH:131]1.[O:132]=[C:133]([CH:134]=[CH:135][c:136]1[cH:137][cH:138][cH:139][cH:140][cH:141]1)[CH:142]=[CH:143][c:144]1[cH:145][cH:146][cH:147][cH:148][cH:149]1.[O:96]=[C:97]([CH:98]=[CH:99][c:100]1[cH:101][cH:102][cH:103][cH:104][cH:105]1)[CH:106]=[CH:107][c:108]1[cH:109][cH:110][cH:111][cH:112][cH:113]1.[Pd:94].[Pd:95].[c:1]1([P:2]([c:3]2[cH:4][cH:5][cH:6][cH:7][cH:8]2)[c:9]2[cH:10][cH:11][c:12]3[c:13]([cH:14][cH:15][cH:16][cH:17]3)[c:18]2-[c:19]2[c:20]3[c:21]([cH:22][cH:23][cH:24][cH:25]3)[cH:26][cH:27][c:28]2[P:29]([c:30]2[cH:31][cH:32][cH:33][cH:34][cH:35]2)[c:36]2[cH:37][cH:38][cH:39][cH:40][cH:41]2)[cH:42][cH:43][cH:44][cH:45][cH:46]1>>[c:54]1([N:77]2[CH2:76][CH2:75][NH:80][CH2:79][CH2:78]2)[cH:55][c:56]([CH3:74])[cH:57][c:58]2[c:63]1[O:62][CH2:61][CH2:60][N:59]2[S:64](=[O:65])(=[O:66])[c:67]1[cH:68][cH:69][c:70]([Cl:73])[cH:71][cH:72]1Participants
10
Reactant 9
Product 1
Sources & evidence
- ORD record
- ord-ea3aea7ff2c4417ebec9ef002999c91f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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