Acetate → HCID 46182230, compound

HRID 200976Notes

Reaction equation

HRID 200976 reaction equation
[C:83]([O-:84])(=[O:85])[CH3:86].[C:88]([O-:89])(=[O:90])[CH3:91].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]([S:9](=[O:10])(=[O:11])[c:12]1[cH:13][cH:14][cH:15][cH:16][cH:17]1)[c:18]1[cH:19][c:20]([Br:24])[cH:21][cH:22][cH:23]1.[CH3:71][C:72]([CH3:73])([O-:74])[CH3:75].[CH:37]1([P:38]([CH:39]2[CH2:40][CH2:41][CH2:42][CH2:43][CH2:44]2)[c:45]2[cH:46][cH:47][cH:48][cH:49][c:50]2-[c:51]2[c:52]([CH:53]([CH3:54])[CH3:55])[cH:56][c:57]([CH:58]([CH3:59])[CH3:60])[cH:61][c:62]2[CH:63]([CH3:64])[CH3:65])[CH2:66][CH2:67][CH2:68][CH2:69][CH2:70]1.[Na+:76].[O:77]1[CH2:78][CH2:79][O:80][CH2:81][CH2:82]1.[Pd+2:87].[c:25]1([N:31]2[CH2:32][CH2:33][NH:34][CH2:35][CH2:36]2)[cH:26][cH:27][cH:28][cH:29][cH:30]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]([S:9](=[O:10])(=[O:11])[c:12]1[cH:13][cH:14][cH:15][cH:16][cH:17]1)[c:18]1[cH:19][c:20]([N:34]2[CH2:33][CH2:32][N:31]([c:25]3[cH:26][cH:27][cH:28][cH:29][cH:30]3)[CH2:36][CH2:35]2)[cH:21][cH:22][cH:23]1

Participants

9

Reactant 8

HCID 175Acetate2×HCID 923Sodium ionHCID 70961-PhenylpiperazineHCID 312751,4-DioxaneHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 45749132-Methylpropan-2-olateHCID 111557942-Dicyclohexylphosphino-2',4',6'-triisoprophylbiphenylHCID 46021782HCID 46021782, compound

Product 1

HCID 46182230HCID 46182230, compound

Sources & evidence

ORD record
ord-5e4a6cdd321546d7ac55633b162c4b60
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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