Hydrochloric Acid → 2-(ethyloxy)-N-(2-(4-fluorophenyl)-2-oxo-1-((4-(trifluoromethyl)phenyl)methyl)ethyl)-1-naphthalenecarboxamide

HRID 2336542Notes

Reaction equation

HRID 2336542 reaction equation
[CH2:24]([CH3:25])[O:26][c:27]1[c:28]([C:37](=[O:38])[OH:39])[c:29]2[cH:30][cH:31][cH:32][cH:33][c:34]2[cH:35][cH:36]1.[CH2:41]([N:42]=[C:43]=[N:44][CH2:45][CH2:46][CH2:47][N:48]([CH3:49])[CH3:50])[CH3:51].[CH3:63][N:64]([CH3:65])[CH:66]=[O:67].[ClH:1].[ClH:40].[ClH:62].[F:2][c:3]1[cH:4][cH:5][c:6]([C:9]([CH:10]([CH2:11][c:12]2[cH:13][cH:14][c:15]([C:18]([F:19])([F:20])[F:21])[cH:16][cH:17]2)[NH2:22])=[O:23])[cH:7][cH:8]1.[OH2:68].[OH:52][n:53]1[c:54]2[cH:55][cH:56][cH:57][cH:58][c:59]2[n:60][n:61]1>>[F:2][c:3]1[cH:4][cH:5][c:6]([C:9]([CH:10]([CH2:11][c:12]2[cH:13][cH:14][c:15]([C:18]([F:19])([F:20])[F:21])[cH:16][cH:17]2)[NH:22][C:37]([c:28]2[c:27]([O:26][CH2:24][CH3:25])[cH:36][cH:35][c:34]3[c:29]2[cH:30][cH:31][cH:32][cH:33]3)=[O:38])=[O:23])[cH:7][cH:8]1

Participants

8

Reactant 7

HCID 313Hydrochloric Acid3×HCID 962WaterHCID 6228DimethylformamideHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 752102-Ethoxy-1-naphthoic acidHCID 757711-HydroxybenzotriazoleHCID 222621962-Amino-1-(4-fluorophenyl)-3-[4-(trifluoromethyl)phenyl]propan-1-one

Product 1

HCID 222620222-(ethyloxy)-N-(2-(4-fluorophenyl)-2-oxo-1-((4-(trifluoromethyl)phenyl)methyl)ethyl)-1-naphthalenecarboxamide

Sources & evidence

ORD record
ord-c0bd5a5aa742422289b53cca222267af
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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