Water → 4-(3-chlorophenyl)-6-[(4-chlorophenyl)hydroxy(4-methyl-4H-1,2,4-triazol-3-yl)methyl]-1-methyl-2(1H)-quinolinone

HRID 151182Notes

Reaction equation

HRID 151182 reaction equation
[CH3:34][C:35]([CH3:36])([CH3:37])[OH:38].[CH3:41][N:42]([CH3:43])[CH:44]=[O:45].[Cl:1][c:2]1[cH:3][c:4](-[c:8]2[cH:9][c:10](=[O:33])[n:11]([CH3:32])[c:12]3[cH:13][cH:14][c:15]([CH:18]([c:19]4[n:20][n:21][cH:22][n:23]4[CH3:24])[c:25]4[cH:26][cH:27][c:28]([Cl:31])[cH:29][cH:30]4)[cH:16][c:17]23)[cH:5][cH:6][cH:7]1.[K:39].[OH2:40]>>[Cl:1][c:2]1[cH:3][c:4](-[c:8]2[cH:9][c:10](=[O:33])[n:11]([CH3:32])[c:12]3[cH:13][cH:14][c:15]([C:18]([c:19]4[n:20][n:21][cH:22][n:23]4[CH3:24])([c:25]4[cH:26][cH:27][c:28]([Cl:31])[cH:29][cH:30]4)[OH:38])[cH:16][c:17]23)[cH:5][cH:6][cH:7]1

Participants

6

Reactant 5

HCID 962WaterHCID 6228DimethylformamideHCID 6386tert-ButanolHCID 5462222PotassiumHCID 98910924-(3-chlorophenyl)-6-[(4-chlorophenyl)(4-methyl-4H-1,2,4-triazol-3-yl)methyl]-1-methyl-2(1H)-quinolinone

Product 1

HCID 210820404-(3-chlorophenyl)-6-[(4-chlorophenyl)hydroxy(4-methyl-4H-1,2,4-triazol-3-yl)methyl]-1-methyl-2(1H)-quinolinone

Sources & evidence

ORD record
ord-b05dc1eff9d54994861eb2c15ce5df11
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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