Acetate → N-(3,4-Dichlorophenyl)-3-[2-(4-methylpiperazin-1-yl)phenyl]-acrylamide

HRID 91628

Reaction equation

HRID 91628 reaction equation
[CH3:1][N:2]1[CH2:3][CH2:4][N:5]([c:8]2[c:9]([NH2:10])[cH:11][cH:12][cH:13][cH:14]2)[CH2:6][CH2:7]1.[CH3:39][OH:40].[Cl:25][c:26]1[cH:27][c:28]([NH:33][C:34]([CH:35]=[CH2:36])=[O:37])[cH:29][cH:30][c:31]1[Cl:32].[F:16][B-:17]([F:18])([F:19])[F:20].[H+:15].[N:21]([O-:22])=[O:23].[Na+:24].[O-:42][C:43]([CH3:44])=[O:45].[O-:46][C:47]([CH3:48])=[O:49].[OH2:38].[Pd+2:41]>>[CH3:1][N:2]1[CH2:3][CH2:4][N:5]([c:8]2[c:9]([CH:36]=[CH:35][C:34]([NH:33][c:28]3[cH:27][c:26]([Cl:25])[c:31]([Cl:32])[cH:30][cH:29]3)=[O:37])[cH:11][cH:12][cH:13][cH:14]2)[CH2:6][CH2:7]1

Participants

11

Reactant 10

HCID 175Acetate2×HCID 887MethanolHCID 923Sodium ionHCID 946NitriteHCID 962WaterHCID 1038Hydrogen cationHCID 26255TetrafluoroborateHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 2865472-(4-Methylpiperazin-1-yl)anilineHCID 13411358N-(3,4-Dichlorophenyl)prop-2-enamide

Product 1

HCID 70046281N-(3,4-Dichlorophenyl)-3-[2-(4-methylpiperazin-1-yl)phenyl]-acrylamide

Sources & evidence

ORD record
ord-693a28b29d8a4deca55bb7d1a9a80b9e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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