Sodium ion → HCID 25183186, compound

HRID 134877Notes

Reaction equation

HRID 134877 reaction equation
[Br:1][c:2]1[cH:3][n:4][c:5]([S:7](=[O:8])(=[O:9])[c:10]2[cH:11][cH:12][c:13]([O:16][CH3:17])[cH:14][cH:15]2)[s:6]1.[CH2:46]1[O:47][CH2:48][CH2:49][O:50][CH2:51]1.[CH3:18][C:19]1([CH3:20])[C:21]([CH3:22])([CH3:23])[O:24][B:25]([c:26]2[cH:27][c:28]3[c:29]([n:30][c:31]([NH:33][C:34]([CH3:35])=[O:36])[s:32]3)[cH:37][cH:38]2)[O:39]1.[Na+:40].[Na+:41].[O-:42][C:43](=[O:44])[O-:45].[cH:52]1[cH:53][cH:54][c:55]([P:56]([Pd:57]([P:58]([c:59]2[cH:60][cH:61][cH:62][cH:63][cH:64]2)([c:65]2[cH:66][cH:67][cH:68][cH:69][cH:70]2)[c:71]2[cH:72][cH:73][cH:74][cH:75][cH:76]2)([P:77]([c:78]2[cH:79][cH:80][cH:81][cH:82][cH:83]2)([c:84]2[cH:85][cH:86][cH:87][cH:88][cH:89]2)[c:90]2[cH:91][cH:92][cH:93][cH:94][cH:95]2)[P:96]([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)([c:115]2[cH:116][cH:117][cH:118][cH:119][cH:120]2)[c:121]2[cH:122][cH:123][cH:124][cH:125][cH:126]2)[cH:127][cH:128]1>>[c:2]1(-[c:26]2[cH:27][c:28]3[c:29]([n:30][c:31]([NH:33][C:34]([CH3:35])=[O:36])[s:32]3)[cH:37][cH:38]2)[cH:3][n:4][c:5]([S:7](=[O:8])(=[O:9])[c:10]2[cH:11][cH:12][c:13]([O:16][CH3:17])[cH:14][cH:15]2)[s:6]1

Participants

7

Reactant 6

HCID 923Sodium ion2×HCID 19660Carbonate IonHCID 312751,4-DioxaneHCID 51354026n-(6-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)benzo[d]thiazol-2-yl)acetamideHCID 57585157HCID 57585157, compoundHCID 178420554HCID 178420554, compound

Product 1

HCID 25183186HCID 25183186, compound

Sources & evidence

ORD record
ord-9aa8cc559de546d6ae242d7834d7de24
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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