Cyanide → HCID 57833595, compound

HRID 2124869Notes

Reaction equation

HRID 2124869 reaction equation
[C-:117]#[N:118].[C-:120]#[N:121].[C-:37]#[N:38].[F:1][C:2]([C:3](=[O:4])[N:5]1[CH:6]2[CH2:7][C:8](=[C:13]3[c:14]4[cH:15][cH:16][cH:17][cH:18][c:19]4[O:20][c:21]4[c:22]([O:27][S:28]([C:29]([F:30])([F:31])[F:32])(=[O:33])=[O:34])[cH:23][cH:24][cH:25][c:26]43)[CH2:9][CH:10]1[CH2:11][CH2:12]2)([F:35])[F:36].[O:122]=[CH:123][N:124]([CH3:125])[CH3:126].[Pd:39].[Pd:40].[Zn+2:119].[c:41]1([P:42]([c:43]2[cH:44][cH:45][cH:46][cH:47][cH:48]2)[c:49]2[cH:50][cH:51][cH:52][cH:53][cH:54]2)[cH:55][cH:56][cH:57][cH:58][cH:59]1.[c:60]1([P:61]([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)[cH:74][cH:75][cH:76][cH:77][cH:78]1.[c:79]1([P:80]([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)[cH:93][cH:94][cH:95][cH:96][cH:97]1.[c:98]1([P:99]([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)[cH:112][cH:113][cH:114][cH:115][cH:116]1>>[F:1][C:2]([C:3](=[O:4])[N:5]1[CH:6]2[CH2:7][C:8](=[C:13]3[c:14]4[cH:15][cH:16][cH:17][cH:18][c:19]4[O:20][c:21]4[c:22]([C:37]#[N:38])[cH:23][cH:24][cH:25][c:26]43)[CH2:9][CH:10]1[CH2:11][CH2:12]2)([F:35])[F:36]

Participants

7

Sources & evidence

ORD record
ord-272cb1735ddf4cd090f1064eb7af8ca9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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