Sodium ion → HCID 67336561, compound

HRID 2132328Notes

Reaction equation

HRID 2132328 reaction equation
[Br:7][c:8]1[cH:9][cH:10][cH:11][cH:12][n:13]1.[CH3:1][C:2]([CH3:3])([O-:4])[CH3:5].[CH3:35][c:36]1[cH:37][cH:38][cH:39][cH:40][cH:41]1.[NH2:14][CH2:15][c:16]1[c:17]([Cl:34])[cH:18][cH:19][c:20]2[c:26]1[CH2:25][CH2:24][N:23]([C:27](=[O:28])[O:29][C:30]([CH3:31])([CH3:32])[CH3:33])[CH2:22][CH2:21]2.[Na+:6].[O:44]=[C:45]([CH:46]=[CH:47][c:48]1[cH:49][cH:50][cH:51][cH:52][cH:53]1)[CH:54]=[CH:55][c:56]1[cH:57][cH:58][cH:59][cH:60][cH:61]1.[O:62]=[C:63]([CH:64]=[CH:65][c:66]1[cH:67][cH:68][cH:69][cH:70][cH:71]1)[CH:72]=[CH:73][c:74]1[cH:75][cH:76][cH:77][cH:78][cH:79]1.[O:80]=[C:81]([CH:82]=[CH:83][c:84]1[cH:85][cH:86][cH:87][cH:88][cH:89]1)[CH:90]=[CH:91][c:92]1[cH:93][cH:94][cH:95][cH:96][cH:97]1.[Pd:42].[Pd:43]>>[c:8]1([NH:14][CH2:15][c:16]2[c:17]([Cl:34])[cH:18][cH:19][c:20]3[c:26]2[CH2:25][CH2:24][N:23]([C:27](=[O:28])[O:29][C:30]([CH3:31])([CH3:32])[CH3:33])[CH2:22][CH2:21]3)[cH:9][cH:10][cH:11][cH:12][n:13]1

Participants

8

Reactant 7

HCID 923Sodium ionHCID 1140TolueneHCID 79732-BromopyridineHCID 23938Palladium2×HCID 95417Dibenzylidene acetone3×HCID 45749132-Methylpropan-2-olateHCID 59822294HCID 59822294, compound

Product 1

HCID 67336561HCID 67336561, compound

Sources & evidence

ORD record
ord-3c519e45996448e8b006cf0e0c6b160f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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