Sodium ion → 2-[5-(4-Chloro-phenyl)-1-(2,4-dichloro-phenyl)-4-methyl-1H-pyrazol-3-yl]-3,5,5-trimethyl-3,5-dihydro-imidazol-4-one

HRID 1240356Notes

Reaction equation

HRID 1240356 reaction equation
[CH3:32][I:33].[Cl:3][c:4]1[cH:5][cH:6][c:7](-[c:10]2[c:11]([CH3:31])[c:12]([C:23]3=[N:24][C:25]([CH3:29])([CH3:30])[C:26](=[O:28])[NH:27]3)[n:13][n:14]2-[c:15]2[c:16]([Cl:22])[cH:17][c:18]([Cl:21])[cH:19][cH:20]2)[cH:8][cH:9]1.[H-:1].[Na+:2].[O:35]=[CH:36][N:37]([CH3:38])[CH3:39].[OH2:34]>>[Cl:3][c:4]1[cH:5][cH:6][c:7](-[c:10]2[c:11]([CH3:31])[c:12]([C:23]3=[N:24][C:25]([CH3:29])([CH3:30])[C:26](=[O:28])[N:27]3[CH3:32])[n:13][n:14]2-[c:15]2[c:16]([Cl:22])[cH:17][c:18]([Cl:21])[cH:19][cH:20]2)[cH:8][cH:9]1

Participants

7

Reactant 6

HCID 923Sodium ionHCID 962WaterHCID 6228DimethylformamideHCID 6328Methyl iodideHCID 166653HydrideHCID 441916922-[5-(4-chloro-phenyl)-1-(2,4-dichloro-phenyl)-4-methyl-1H-pyrazol-3-yl]-5,5-dimethyl-3,5-dihydro-imidazol-4-one

Product 1

HCID 441918822-[5-(4-Chloro-phenyl)-1-(2,4-dichloro-phenyl)-4-methyl-1H-pyrazol-3-yl]-3,5,5-trimethyl-3,5-dihydro-imidazol-4-one

Sources & evidence

ORD record
ord-cf8664c5931e4a138202e6d374bfc1a2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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