Dichloromethane → 4-[5-(3,5-dichlorophenyl)-4,5-dihydro-5-(trifluoromethyl)-3-isoxazolyl]-N-(2,2,2-trifluoroethyl)-1-naphthalenecarboxamide

HRID 163180Notes

Reaction equation

HRID 163180 reaction equation
[CH2:62]([P:63]([OH:64])([OH:65])=[O:66])[CH2:67][CH3:68].[CH3:75][N:76]([CH3:77])[c:78]1[cH:79][cH:80][n:81][cH:82][cH:83]1.[Cl:1][c:2]1[cH:3][c:4]([C:9]2([C:27]([F:28])([F:29])[F:30])[CH2:10][C:11]([c:14]3[cH:15][cH:16][c:17]([C:24](=[O:25])[OH:26])[c:18]4[cH:19][cH:20][cH:21][cH:22][c:23]34)=[N:12][O:13]2)[cH:5][c:6]([Cl:8])[cH:7]1.[Cl:31][c:32]1[cH:33][c:34]([C:35]2([C:36]([F:37])([F:38])[F:39])[O:40][N:41]=[C:42]([c:43]3[c:44]4[c:45]([cH:46][cH:47][cH:48][cH:49]4)[c:50]([C:51]([O:52][CH3:53])=[O:54])[cH:55][cH:56]3)[CH2:57]2)[cH:58][c:59]([Cl:60])[cH:61]1.[Cl:84][CH2:85][Cl:86].[F:69][C:70]([CH2:71][NH2:72])([F:73])[F:74]>>[Cl:1][c:2]1[cH:3][c:4]([C:9]2([C:27]([F:28])([F:29])[F:30])[CH2:10][C:11]([c:14]3[cH:15][cH:16][c:17]([C:24](=[O:25])[NH:72][CH2:71][C:70]([F:69])([F:73])[F:74])[c:18]4[cH:19][cH:20][cH:21][cH:22][c:23]34)=[N:12][O:13]2)[cH:5][c:6]([Cl:8])[cH:7]1

Participants

7

Reactant 6

HCID 6344DichloromethaneHCID 9773Ethanamine, 2,2,2-trifluoro-HCID 142844-(Dimethylamino)pyridineHCID 204484Propylphosphonic acidHCID 583386304-[5-(3,5-Dichlorophenyl)-4,5-dihydro-5-(trifluoromethyl)-3-isoxazolyl]-1-naphthalenecarboxylic acidHCID 58338637Methyl 4-[5-(3,5-dichlorophenyl)-4,5-dihydro-5-(trifluoromethyl)-3-isoxazolyl]-1-naphthalenecarboxylate

Product 1

HCID 162202114-[5-(3,5-dichlorophenyl)-4,5-dihydro-5-(trifluoromethyl)-3-isoxazolyl]-N-(2,2,2-trifluoroethyl)-1-naphthalenecarboxamide

Sources & evidence

ORD record
ord-89f88c4ee5da496b9297a46b7c7358e0
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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