1,4-Dioxane → 5-(4-Fluorobenzoyl)-6-cyano-2-methylsulfonylnaphthalene
Reaction equation
[F:1][c:2]1[cH:3][cH:4][c:5]([C:6](=[O:7])[c:8]2[c:9]3[cH:10][cH:11][c:12]([S:26](=[O:27])(=[O:28])[CH3:29])[cH:13][c:14]3[cH:15][cH:16][c:17]2[O:18][S:19]([C:20]([F:21])([F:22])[F:23])(=[O:24])=[O:25])[cH:30][cH:31]1.[K:32][C:33]#[N:34].[O:35]1[CH2:36][CH2:37][O:38][CH2:39][CH2:40]1.[cH:41]1[cH:42][cH:43][c:44]([P:45]([Pd:46]([P:47]([c:48]2[cH:49][cH:50][cH:51][cH:52][cH:53]2)([c:54]2[cH:55][cH:56][cH:57][cH:58][cH:59]2)[c:60]2[cH:61][cH:62][cH:63][cH:64][cH:65]2)([P:66]([c:67]2[cH:68][cH:69][cH:70][cH:71][cH:72]2)([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)[P:85]([c:86]2[cH:87][cH:88][cH:89][cH:90][cH:91]2)([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)[c:110]2[cH:111][cH:112][cH:113][cH:114][cH:115]2)[cH:116][cH:117]1>>[F:1][c:2]1[cH:3][cH:4][c:5]([C:6](=[O:7])[c:8]2[c:9]3[cH:10][cH:11][c:12]([S:26](=[O:27])(=[O:28])[CH3:29])[cH:13][c:14]3[cH:15][cH:16][c:17]2[C:33]#[N:34])[cH:30][cH:31]1Participants
5
Sources & evidence
- ORD record
- ord-339f5842483f4a049a81dd2cf1b42ca2
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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