Sodium ion → HCID 59264632, compound
Reaction equation
[C:29]([c:30]1[cH:31][cH:32][cH:33][cH:34][cH:35]1)([c:36]1[cH:37][cH:38][cH:39][cH:40][cH:41]1)=[NH:42].[CH3:105][c:106]1[cH:107][cH:108][cH:109][cH:110][cH:111]1.[CH3:43][C:44]([CH3:45])([O-:46])[CH3:47].[CH:51](=[CH:52][C:53]([CH:54]=[CH:55][c:56]1[cH:57][cH:58][cH:59][cH:60][cH:61]1)=[O:62])[c:63]1[cH:64][cH:65][cH:66][cH:67][cH:68]1.[CH:69](=[CH:70][C:71]([CH:72]=[CH:73][c:74]1[cH:75][cH:76][cH:77][cH:78][cH:79]1)=[O:80])[c:81]1[cH:82][cH:83][cH:84][cH:85][cH:86]1.[CH:87](=[CH:88][C:89]([CH:90]=[CH:91][c:92]1[cH:93][cH:94][cH:95][cH:96][cH:97]1)=[O:98])[c:99]1[cH:100][cH:101][cH:102][cH:103][cH:104]1.[Cl:1][c:2]1[n:3][cH:4][c:5]([F:28])[c:6]([NH:8][CH2:9][c:10]2[c:11](-[c:21]3[c:22]([Cl:27])[cH:23][cH:24][cH:25][cH:26]3)[n:12][c:13]3[c:14]([Cl:20])[cH:15][cH:16][cH:17][c:18]3[cH:19]2)[n:7]1.[Na+:48].[Pd:49].[Pd:50]>>[c:2]1([N:42]=[C:29]([c:30]2[cH:31][cH:32][cH:33][cH:34][cH:35]2)[c:36]2[cH:37][cH:38][cH:39][cH:40][cH:41]2)[n:3][cH:4][c:5]([F:28])[c:6]([NH:8][CH2:9][c:10]2[c:11](-[c:21]3[c:22]([Cl:27])[cH:23][cH:24][cH:25][cH:26]3)[n:12][c:13]3[c:14]([Cl:20])[cH:15][cH:16][cH:17][c:18]3[cH:19]2)[n:7]1Participants
8
Sources & evidence
- ORD record
- ord-f74fbc919bd24bb6a8b64ff795c265ce
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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