Toluene → HCID 19610968, compound
Reaction equation
[Br:1][c:2]1[cH:3][c:4]2[c:5]([c:11]([C:13]([CH3:14])([CH3:15])[CH3:16])[cH:12]1)[S:6][CH2:7][C:8]2([CH3:9])[CH3:10].[CH2:17]([Sn:18]([CH2:19][CH2:20][CH2:21][CH3:27])([c:22]1[o:23][cH:24][cH:25][cH:26]1)[CH2:28][CH2:29][CH2:30][CH3:31])[CH2:32][CH2:33][CH3:34].[CH3:112][c:113]1[cH:114][cH:115][cH:116][cH:117][cH:118]1.[cH:35]1[cH:36][cH:37][c:38]([P:39]([Pd:40]([P:41]([c:42]2[cH:43][cH:44][cH:45][cH:46][cH:47]2)([c:48]2[cH:49][cH:50][cH:51][cH:52][cH:53]2)[c:54]2[cH:55][cH:56][cH:57][cH:58][cH:59]2)([P:60]([c:61]2[cH:62][cH:63][cH:64][cH:65][cH:66]2)([c:67]2[cH:68][cH:69][cH:70][cH:71][cH:72]2)[c:73]2[cH:74][cH:75][cH:76][cH:77][cH:78]2)[P:79]([c:80]2[cH:81][cH:82][cH:83][cH:84][cH:85]2)([c:86]2[cH:87][cH:88][cH:89][cH:90][cH:91]2)[c:92]2[cH:93][cH:94][cH:95][cH:96][cH:97]2)([c:98]2[cH:99][cH:100][cH:101][cH:102][cH:103]2)[c:104]2[cH:105][cH:106][cH:107][cH:108][cH:109]2)[cH:110][cH:111]1>>[c:2]1(-[c:22]2[o:23][cH:24][cH:25][cH:26]2)[cH:3][c:4]2[c:5]([c:11]([C:13]([CH3:14])([CH3:15])[CH3:16])[cH:12]1)[S:6][CH2:7][C:8]2([CH3:9])[CH3:10]Participants
5
Sources & evidence
- ORD record
- ord-b6452468eff74fa3a36f354f5b06a845
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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