Toluene → HCID 67198335, compound
Reaction equation
[Br:1][c:2]1[cH:3][cH:4][n:5][c:6]2[cH:7][cH:8][cH:9][cH:10][c:11]12.[C:12]([CH3:13])([CH3:14])([CH3:15])[O:16][C:17](=[O:18])[N:19]1[CH2:20][CH2:21][CH:22]([NH2:25])[CH2:23][CH2:24]1.[CH3:60][c:61]1[cH:62][cH:63][cH:64][cH:65][cH:66]1.[CH:105](=[CH:106][C:107]([CH:108]=[CH:109][c:110]1[cH:111][cH:112][cH:113][cH:114][cH:115]1)=[O:116])[c:117]1[cH:118][cH:119][cH:120][cH:121][cH:122]1.[CH:26]1([P:27]([CH:28]2[CH2:29][CH2:30][CH2:31][CH2:32][CH2:33]2)[c:34]2[cH:35][cH:36][cH:37][cH:38][c:39]2-[c:40]2[c:41]([CH:42]([CH3:43])[CH3:44])[cH:45][c:46]([CH:47]([CH3:48])[CH3:49])[cH:50][c:51]2[CH:52]([CH3:53])[CH3:54])[CH2:55][CH2:56][CH2:57][CH2:58][CH2:59]1.[CH:69](=[CH:70][C:71]([CH:72]=[CH:73][c:74]1[cH:75][cH:76][cH:77][cH:78][cH:79]1)=[O:80])[c:81]1[cH:82][cH:83][cH:84][cH:85][cH:86]1.[CH:87](=[CH:88][C:89]([CH:90]=[CH:91][c:92]1[cH:93][cH:94][cH:95][cH:96][cH:97]1)=[O:98])[c:99]1[cH:100][cH:101][cH:102][cH:103][cH:104]1.[Pd:67].[Pd:68]>>[c:2]1([NH:25][CH:22]2[CH2:21][CH2:20][N:19]([C:17]([O:16][C:12]([CH3:13])([CH3:14])[CH3:15])=[O:18])[CH2:24][CH2:23]2)[cH:3][cH:4][n:5][c:6]2[cH:7][cH:8][cH:9][cH:10][c:11]12Participants
7
Sources & evidence
- ORD record
- ord-94e92525d6654a8e9dfa3a2d13d51e0c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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