Toluene → HCID 57442336, compound
Reaction equation
[CH2:27]([Sn:28]([CH2:29][CH2:30][CH2:31][CH3:37])([c:32]1[s:33][cH:34][cH:35][n:36]1)[CH2:38][CH2:39][CH2:40][CH3:41])[CH2:42][CH2:43][CH3:44].[CH3:45][c:46]1[cH:47][cH:48][cH:49][cH:50][cH:51]1.[Cl:1][c:2]1[n:3][n:4][c:5]([N:8]2[CH2:9][CH2:10][N:11]([CH2:14][C:15](=[O:16])[N:17]3[CH2:18][CH2:19][N:20]([CH:23]4[CH2:24][CH2:25][CH2:26]4)[CH2:21][CH2:22]3)[CH2:12][CH2:13]2)[cH:6][cH:7]1.[cH:52]1[cH:53][cH:54][c:55]([P:56]([Pd:57]([P:58]([c:59]2[cH:60][cH:61][cH:62][cH:63][cH:64]2)([c:65]2[cH:66][cH:67][cH:68][cH:69][cH:70]2)[c:71]2[cH:72][cH:73][cH:74][cH:75][cH:76]2)([P:77]([c:78]2[cH:79][cH:80][cH:81][cH:82][cH:83]2)([c:84]2[cH:85][cH:86][cH:87][cH:88][cH:89]2)[c:90]2[cH:91][cH:92][cH:93][cH:94][cH:95]2)[P:96]([c:97]2[cH:98][cH:99][cH:100][cH:101][cH:102]2)([c:103]2[cH:104][cH:105][cH:106][cH:107][cH:108]2)[c:109]2[cH:110][cH:111][cH:112][cH:113][cH:114]2)([c:115]2[cH:116][cH:117][cH:118][cH:119][cH:120]2)[c:121]2[cH:122][cH:123][cH:124][cH:125][cH:126]2)[cH:127][cH:128]1>>[c:2]1(-[c:32]2[s:33][cH:34][cH:35][n:36]2)[n:3][n:4][c:5]([N:8]2[CH2:9][CH2:10][N:11]([CH2:14][C:15](=[O:16])[N:17]3[CH2:18][CH2:19][N:20]([CH:23]4[CH2:24][CH2:25][CH2:26]4)[CH2:21][CH2:22]3)[CH2:12][CH2:13]2)[cH:6][cH:7]1Participants
5
Sources & evidence
- ORD record
- ord-dbdee7781fc940738a950de8a6b40ee6
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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