Sodium ion → Methyl 4-cyano-2-(1-ethyl-1H-pyrazol-4-yl)nicotinate
Reaction equation
[C:30](=[O:31])([O-:32])[O-:33].[CH2:14]([CH3:15])[n:16]1[n:17][cH:18][c:19]([B:21]2[O:22][C:23]([CH3:24])([CH3:25])[C:26]([CH3:27])([CH3:28])[O:29]2)[cH:20]1.[CH3:120][CH2:121][O:122][C:123]([CH3:124])=[O:125].[CH3:37][O:38][CH2:39][CH2:40][O:41][CH3:42].[Cl:1][c:2]1[c:3]([C:4](=[O:5])[O:6][CH3:7])[c:8]([C:12]#[N:13])[cH:9][cH:10][n:11]1.[Na+:34].[Na+:35].[OH2:36].[cH:43]1[cH:44][cH:45][c:46]([P:47]([Pd:48]([P:49]([c:50]2[cH:51][cH:52][cH:53][cH:54][cH:55]2)([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)([P:68]([c:69]2[cH:70][cH:71][cH:72][cH:73][cH:74]2)([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)[P:87]([c:88]2[cH:89][cH:90][cH:91][cH:92][cH:93]2)([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)[cH:118][cH:119]1>>[c:2]1(-[c:19]2[cH:18][n:17][n:16]([CH2:14][CH3:15])[cH:20]2)[c:3]([C:4](=[O:5])[O:6][CH3:7])[c:8]([C:12]#[N:13])[cH:9][cH:10][n:11]1Participants
9
Reactant 8
Product 1
Sources & evidence
- ORD record
- ord-51ea458034f14c31b326a4cb96606e63
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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