Water → 4-(5-(3,5-Dichlorophenyl)-5-(trifluoromethyl)-4,5-dihydroisoxazol-3-yl)-2-methyl-N-(2,2,2-trifluoroethyl)benzamide

HRID 677931Notes

Reaction equation

HRID 677931 reaction equation
[CH3:42][CH2:43][N:44]([CH2:45][CH3:46])[CH2:47][CH3:48].[CH3:49][N:50]([CH3:51])[CH:52]=[O:53].[Cl:19][N:20]=[C:21]([OH:22])[CH2:23][CH2:24][C:25]([OH:26])=[O:27].[Cl:28][c:29]1[cH:30][c:31]([C:36](=[CH2:37])[C:38]([F:39])([F:40])[F:41])[cH:32][c:33]([Cl:35])[cH:34]1.[OH2:54].[OH:1][N:2]=[CH:3][c:4]1[cH:5][c:6]([CH3:18])[c:7]([C:8](=[O:9])[NH:10][CH2:11][C:12]([F:13])([F:14])[F:15])[cH:16][cH:17]1>>[O:1]1[N:2]=[C:3]([c:4]2[cH:5][c:6]([CH3:18])[c:7]([C:8](=[O:9])[NH:10][CH2:11][C:12]([F:13])([F:14])[F:15])[cH:16][cH:17]2)[CH2:37][C:36]1([c:31]1[cH:30][c:29]([Cl:28])[cH:34][c:33]([Cl:35])[cH:32]1)[C:38]([F:39])([F:40])[F:41]

Participants

7

Reactant 6

HCID 962WaterHCID 6228DimethylformamideHCID 8471TriethylamineHCID 231598231,3-Dichloro-5-(3,3,3-trifluoroprop-1-en-2-yl)benzeneHCID 860706344-hydroxyiminomethyl-2-methyl-N-(2,2,2-trifluoroethyl)benzoic acid amideHCID 178525519HCID 178525519, compound

Product 1

HCID 446027844-(5-(3,5-Dichlorophenyl)-5-(trifluoromethyl)-4,5-dihydroisoxazol-3-yl)-2-methyl-N-(2,2,2-trifluoroethyl)benzamide

Sources & evidence

ORD record
ord-b6e693bac7c64398bf386e6472c65f76
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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