Toluene → HCID 10312288, compound

HRID 2127024Notes

Reaction equation

HRID 2127024 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[C:9]([CH3:39])([CH3:40])[CH2:10][N:11]([c:14]2[cH:15][n:16][c:17]([NH:20][c:21]3[n:22][cH:23][c:24]4[c:25]([n:26]3)[n:27]([CH:34]3[CH2:35][CH2:36][CH2:37][CH2:38]3)[c:28](=[O:33])[c:29]([Br:32])[c:30]4[CH3:31])[cH:18][cH:19]2)[CH2:12][CH2:13]1.[CH2:41]([Sn:42]([CH2:43][CH2:44][CH2:45][CH3:51])([C:46](=[CH2:47])[O:48][CH2:49][CH3:50])[CH2:52][CH2:53][CH2:54][CH3:55])[CH2:56][CH2:57][CH3:58].[CH3:59][c:60]1[cH:61][cH:62][cH:63][cH:64][cH:65]1.[cH:66]1[cH:67][cH:68][c:69]([P:70]([Pd:71]([P:72]([c:73]2[cH:74][cH:75][cH:76][cH:77][cH:78]2)([c:79]2[cH:80][cH:81][cH:82][cH:83][cH:84]2)[c:85]2[cH:86][cH:87][cH:88][cH:89][cH:90]2)([P:91]([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)[P:110]([c:111]2[cH:112][cH:113][cH:114][cH:115][cH:116]2)([c:117]2[cH:118][cH:119][cH:120][cH:121][cH:122]2)[c:123]2[cH:124][cH:125][cH:126][cH:127][cH:128]2)([c:129]2[cH:130][cH:131][cH:132][cH:133][cH:134]2)[c:135]2[cH:136][cH:137][cH:138][cH:139][cH:140]2)[cH:141][cH:142]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[C:9]([CH3:39])([CH3:40])[CH2:10][N:11]([c:14]2[cH:15][n:16][c:17]([NH:20][c:21]3[n:22][cH:23][c:24]4[c:25]([n:26]3)[n:27]([CH:34]3[CH2:35][CH2:36][CH2:37][CH2:38]3)[c:28](=[O:33])[c:29]([C:46](=[CH2:47])[O:48][CH2:49][CH3:50])[c:30]4[CH3:31])[cH:18][cH:19]2)[CH2:12][CH2:13]1

Participants

5

Sources & evidence

ORD record
ord-d6376da754a944fa8ba7cdc57dc9dd51
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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