Toluene → HCID 68852686, compound
Reaction equation
[CH2:33]([CH2:34][CH2:46][CH3:47])[Sn:35]([CH2:36][CH2:37][CH2:38][CH3:39])([CH2:40][CH2:41][CH2:42][CH3:43])[CH:44]=[CH2:45].[CH3:1][O:2][C:3]([CH2:4][CH2:5][c:6]1[c:7]([CH3:31])[cH:8][c:9]([S:12][CH:13]([CH3:14])[c:15]2[s:16][c:17](-[c:21]3[cH:22][cH:23][c:24]([C:27]([F:28])([F:29])[F:30])[cH:25][cH:26]3)[cH:18][c:19]2[I:20])[cH:10][cH:11]1)=[O:32].[CH3:48][c:49]1[cH:50][cH:51][cH:52][cH:53][cH:54]1.[cH:55]1[cH:56][cH:57][c:58]([P:59]([Pd:60]([P:61]([c:62]2[cH:63][cH:64][cH:65][cH:66][cH:67]2)([c:68]2[cH:69][cH:70][cH:71][cH:72][cH:73]2)[c:74]2[cH:75][cH:76][cH:77][cH:78][cH:79]2)([P:80]([c:81]2[cH:82][cH:83][cH:84][cH:85][cH:86]2)([c:87]2[cH:88][cH:89][cH:90][cH:91][cH:92]2)[c:93]2[cH:94][cH:95][cH:96][cH:97][cH:98]2)[P:99]([c:100]2[cH:101][cH:102][cH:103][cH:104][cH:105]2)([c:106]2[cH:107][cH:108][cH:109][cH:110][cH:111]2)[c:112]2[cH:113][cH:114][cH:115][cH:116][cH:117]2)([c:118]2[cH:119][cH:120][cH:121][cH:122][cH:123]2)[c:124]2[cH:125][cH:126][cH:127][cH:128][cH:129]2)[cH:130][cH:131]1>>[CH3:1][O:2][C:3]([CH2:4][CH2:5][c:6]1[c:7]([CH3:31])[cH:8][c:9]([S:12][CH:13]([CH3:14])[c:15]2[s:16][c:17](-[c:21]3[cH:22][cH:23][c:24]([C:27]([F:28])([F:29])[F:30])[cH:25][cH:26]3)[cH:18][c:19]2[CH:33]=[CH2:34])[cH:10][cH:11]1)=[O:32]Participants
5
Sources & evidence
- ORD record
- ord-bca0f943e0f34e44bb9fdb2d20d9ce2e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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