1,4-Dioxane → HCID 68540423, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][C:8]1=[N:13][C:12]([CH3:14])([c:15]2[cH:16][c:17]([Br:22])[c:18]([F:21])[cH:19][cH:20]2)[CH2:11][CH2:10][S:9]1)=[O:23].[CH2:24]([Sn:25]([CH2:26][CH2:27][CH2:28][CH3:35])([c:29]1[n:30][cH:31][cH:32][n:33][cH:34]1)[CH2:36][CH2:37][CH2:38][CH3:39])[CH2:40][CH2:41][CH3:42].[O:43]1[CH2:44][CH2:45][O:46][CH2:47][CH2:48]1.[cH:49]1[cH:50][cH:51][c:52]([P:53]([Pd:54]([P:55]([c:56]2[cH:57][cH:58][cH:59][cH:60][cH:61]2)([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)([P:74]([c:75]2[cH:76][cH:77][cH:78][cH:79][cH:80]2)([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)[P:93]([c:94]2[cH:95][cH:96][cH:97][cH:98][cH:99]2)([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)[cH:124][cH:125]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][C:8]1=[N:13][C:12]([CH3:14])([c:15]2[cH:16][c:17](-[c:29]3[n:30][cH:31][cH:32][n:33][cH:34]3)[c:18]([F:21])[cH:19][cH:20]2)[CH2:11][CH2:10][S:9]1)=[O:23]Participants
5
Sources & evidence
- ORD record
- ord-e18c67dcc9774afca2dd10ccd7780b92
- Source dataset
- Test data from https://doi.org/10.1039/C8SC04228D
Reaction notes
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