Water → HCID 17848320, compound

HRID 202600Notes

Reaction equation

HRID 202600 reaction equation
[CH3:44][N:45]([CH3:46])[CH:47]=[O:48].[Cl:1][c:2]1[n:3][cH:4][c:5]([C:19](=[O:20])[c:21]2[cH:22][c:23]([O:31][CH3:32])[c:24]([O:29][CH3:30])[c:25]([O:27][CH3:28])[cH:26]2)[c:6]([NH:8][CH2:9][c:10]2[cH:11][c:12]([Cl:18])[c:13]([O:16][CH3:17])[cH:14][cH:15]2)[n:7]1.[K:33][C:34]#[N:35].[OH2:43].[OH:36][CH:37]1[CH2:38][CH2:39][NH:40][CH2:41][CH2:42]1.[Pd:68]([Cl:69])[Cl:70].[c:49]1([P:50]([c:51]2[cH:52][cH:53][cH:54][cH:55][cH:56]2)[c:57]2[cH:58][cH:59][cH:60][cH:61][cH:62]2)[cH:63][cH:64][cH:65][cH:66][cH:67]1>>[c:2]1([C:34]#[N:35])[n:3][cH:4][c:5]([C:19](=[O:20])[c:21]2[cH:22][c:23]([O:31][CH3:32])[c:24]([O:29][CH3:30])[c:25]([O:27][CH3:28])[cH:26]2)[c:6]([NH:8][CH2:9][c:10]2[cH:11][c:12]([Cl:18])[c:13]([O:16][CH3:17])[cH:14][cH:15]2)[n:7]1

Participants

8

Reactant 7

HCID 962WaterHCID 6228DimethylformamideHCID 11776TriphenylphosphineHCID 24290Palladium ChlorideHCID 79341Piperidin-4-olHCID 17848364HCID 17848364, compoundHCID 178511842HCID 178511842, compound

Product 1

HCID 17848320HCID 17848320, compound

Sources & evidence

ORD record
ord-b0b8f5615a744aefbaacbf631bd65174
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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