Sodium ion → HCID 68554308, compound

HRID 2131335Notes

Reaction equation

HRID 2131335 reaction equation
[CH3:29][C:30]([CH3:31])([O-:32])[CH3:33].[I:1][c:2]1[n:3][n:4]2[c:5]([c:6](-[c:10]3[cH:11][cH:12][c:13]([O:16][CH3:17])[cH:14][cH:15]3)[cH:7][cH:8][cH:9]2)[n:18]1.[NH2:19][c:20]1[cH:21][n:22][n:23]([CH2:25][CH:26]([CH3:27])[OH:28])[cH:24]1.[Na+:34].[O:103]=[C:104]([CH:105]=[CH:106][c:107]1[cH:108][cH:109][cH:110][cH:111][cH:112]1)[CH:113]=[CH:114][c:115]1[cH:116][cH:117][cH:118][cH:119][cH:120]1.[O:121]=[C:122]([CH:123]=[CH:124][c:125]1[cH:126][cH:127][cH:128][cH:129][cH:130]1)[CH:131]=[CH:132][c:133]1[cH:134][cH:135][cH:136][cH:137][cH:138]1.[O:77]1[CH2:78][CH2:79][O:80][CH2:81][CH2:82]1.[O:85]=[C:86]([CH:87]=[CH:88][c:89]1[cH:90][cH:91][cH:92][cH:93][cH:94]1)[CH:95]=[CH:96][c:97]1[cH:98][cH:99][cH:100][cH:101][cH:102]1.[Pd:83].[Pd:84].[c:35]1([P:36]([c:37]2[cH:38][cH:39][cH:40][cH:41][cH:42]2)[c:43]2[c:44]3[c:68]([cH:69][cH:70][cH:71]2)[C:65]([CH3:66])([CH3:67])[c:47]2[c:46]([c:51]([P:52]([c:53]4[cH:54][cH:55][cH:56][cH:57][cH:58]4)[c:59]4[cH:60][cH:61][cH:62][cH:63][cH:64]4)[cH:50][cH:49][cH:48]2)[O:45]3)[cH:72][cH:73][cH:74][cH:75][cH:76]1>>[c:2]1([NH:19][c:20]2[cH:21][n:22][n:23]([CH2:25][CH:26]([CH3:27])[OH:28])[cH:24]2)[n:3][n:4]2[c:5]([c:6](-[c:10]3[cH:11][cH:12][c:13]([O:16][CH3:17])[cH:14][cH:15]3)[cH:7][cH:8][cH:9]2)[n:18]1

Participants

9

Reactant 8

HCID 923Sodium ionHCID 23938Palladium2×HCID 312751,4-DioxaneHCID 95417Dibenzylidene acetone3×HCID 6360441,1'-(9,9-Dimethyl-9H-xanthene-4,5-diyl)bis(1,1-diphenylphosphine)HCID 45749132-Methylpropan-2-olateHCID 591990962-Iodo-8-(4-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridineHCID 65278140HCID 65278140, compound

Product 1

HCID 68554308HCID 68554308, compound

Sources & evidence

ORD record
ord-5dc50d7cc1a1488da3936d2f34e847f3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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