Toluene → HCID 66974643, compound
Reaction equation
[C:19]([CH3:20])([CH3:21])([CH3:22])[O:23][C:24]([N:25]([CH3:26])[CH2:27][c:28]1[cH:29][n:30]([S:34](=[O:35])(=[O:36])[c:37]2[cH:38][n:39][cH:40][cH:41][cH:42]2)[c:31]([Br:33])[cH:32]1)=[O:43].[CH2:1]([Sn:2]([CH2:3][CH2:4][CH2:5][CH3:11])([c:6]1[s:7][cH:8][cH:9][cH:10]1)[CH2:12][CH2:13][CH2:14][CH3:15])[CH2:16][CH2:17][CH3:18].[CH3:44][c:45]1[cH:46][cH:47][cH:48][cH:49][cH:50]1.[cH:51]1[cH:52][cH:53][c:54]([P:55]([Pd:56]([P:57]([c:58]2[cH:59][cH:60][cH:61][cH:62][cH:63]2)([c:64]2[cH:65][cH:66][cH:67][cH:68][cH:69]2)[c:70]2[cH:71][cH:72][cH:73][cH:74][cH:75]2)([P:76]([c:77]2[cH:78][cH:79][cH:80][cH:81][cH:82]2)([c:83]2[cH:84][cH:85][cH:86][cH:87][cH:88]2)[c:89]2[cH:90][cH:91][cH:92][cH:93][cH:94]2)[P:95]([c:96]2[cH:97][cH:98][cH:99][cH:100][cH:101]2)([c:102]2[cH:103][cH:104][cH:105][cH:106][cH:107]2)[c:108]2[cH:109][cH:110][cH:111][cH:112][cH:113]2)([c:114]2[cH:115][cH:116][cH:117][cH:118][cH:119]2)[c:120]2[cH:121][cH:122][cH:123][cH:124][cH:125]2)[cH:126][cH:127]1>>[c:6]1(-[c:31]2[n:30]([S:34](=[O:35])(=[O:36])[c:37]3[cH:38][n:39][cH:40][cH:41][cH:42]3)[cH:29][c:28]([CH2:27][N:25]([C:24]([O:23][C:19]([CH3:20])([CH3:21])[CH3:22])=[O:43])[CH3:26])[cH:32]2)[s:7][cH:8][cH:9][cH:10]1Participants
5
Sources & evidence
- ORD record
- ord-91c0b19f72204e7ead7a3e6ea1789f06
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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