Potassium Cation → 2-Cyclopropyl-7-fluoro-5-methyl-6-(thiophen-3-yl)-1,3-benzoxazole-4-carbonitrile
Reaction equation
[Br:1][c:2]1[c:3]([F:17])[c:4]2[c:5]([n:6][c:7]([CH:9]3[CH2:10][CH2:11]3)[o:8]2)[c:12]([C:15]#[N:16])[c:13]1[CH3:14].[CH2:34]1[O:35][CH2:36][CH2:37][O:38][CH2:39]1.[K+:31].[K+:32].[K+:33].[P:26]([O-:27])([O-:28])([O-:29])=[O:30].[cH:40]1[cH:41][cH:42][c:43]([P:44]([Pd:45]([P:46]([c:47]2[cH:48][cH:49][cH:50][cH:51][cH:52]2)([c:53]2[cH:54][cH:55][cH:56][cH:57][cH:58]2)[c:59]2[cH:60][cH:61][cH:62][cH:63][cH:64]2)([P:65]([c:66]2[cH:67][cH:68][cH:69][cH:70][cH:71]2)([c:72]2[cH:73][cH:74][cH:75][cH:76][cH:77]2)[c:78]2[cH:79][cH:80][cH:81][cH:82][cH:83]2)[P:84]([c:85]2[cH:86][cH:87][cH:88][cH:89][cH:90]2)([c:91]2[cH:92][cH:93][cH:94][cH:95][cH:96]2)[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)[cH:115][cH:116]1.[s:18]1[cH:19][c:20]([B:23]([OH:24])[OH:25])[cH:21][cH:22]1>>[c:2]1(-[c:20]2[cH:19][s:18][cH:22][cH:21]2)[c:3]([F:17])[c:4]2[c:5]([n:6][c:7]([CH:9]3[CH2:10][CH2:11]3)[o:8]2)[c:12]([C:15]#[N:16])[c:13]1[CH3:14]Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-868e09fb1f624b7db156faf81e63e9f0
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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