Acetate → HCID 59837686, compound

HRID 2140129Notes

Reaction equation

HRID 2140129 reaction equation
[Br:22][c:23]1[cH:24][c:25]([S:29][CH2:30][CH2:31][N:32]2[CH2:33][CH2:34][CH2:35][CH2:36]2)[cH:26][cH:27][cH:28]1.[C:49]([O-:50])(=[O:51])[CH3:52].[C:54]([O-:55])(=[O:56])[CH3:57].[CH3:37][C:38]([CH3:39])([O-:40])[CH3:41].[Cl:1][c:2]1[c:3](-[c:10]2[cH:11][c:12]3[c:13]([n:14][c:15]([NH2:18])[n:16][n:17]3)[c:19]([CH3:21])[cH:20]2)[cH:4][c:5]([O:8][CH3:9])[cH:6][cH:7]1.[K+:42].[O:43]1[CH2:44][CH2:45][O:46][CH2:47][CH2:48]1.[Pd+2:53]>>[Cl:1][c:2]1[c:3](-[c:10]2[cH:11][c:12]3[c:13]([n:14][c:15]([NH:18][c:23]4[cH:24][c:25]([S:29][CH2:30][CH2:31][N:32]5[CH2:33][CH2:34][CH2:35][CH2:36]5)[cH:26][cH:27][cH:28]4)[n:16][n:17]3)[c:19]([CH3:21])[cH:20]2)[cH:4][c:5]([O:8][CH3:9])[cH:6][cH:7]1

Participants

8

Reactant 7

HCID 175Acetate2×HCID 813Potassium CationHCID 312751,4-DioxaneHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 45749132-Methylpropan-2-olateHCID 248227537-(2-Chloro-5-methoxyphenyl)-5-methylbenzo[e][1,2,4]triazin-3-amineHCID 59837630HCID 59837630, compound

Product 1

HCID 59837686HCID 59837686, compound

Sources & evidence

ORD record
ord-252a612ba1a14389b9536903c3623ceb
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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