1,2-Dichloroethane → (RS)-2-(3,5-Bis-trifluoromethyl-phenyl)-N-[4-chloro-2-(2-chloro-phenylsulfanyl)-phenyl]-N-methyl-propionamide

HRID 141884Notes

Reaction equation

HRID 141884 reaction equation
[CH:37]1([N:38]=[C:39]=[N:40][CH:41]2[CH2:42][CH2:43][CH2:44][CH2:45][CH2:46]2)[CH2:47][CH2:48][CH2:49][CH2:50][CH2:51]1.[Cl:1][c:2]1[cH:3][c:4]([S:10][c:11]2[c:12]([Cl:17])[cH:13][cH:14][cH:15][cH:16]2)[c:5]([NH:8][CH3:9])[cH:6][cH:7]1.[Cl:52][CH2:53][CH2:54][Cl:55].[F:18][C:19]([c:20]1[cH:21][c:22]([CH:30]([C:31](=[O:32])[OH:33])[CH3:34])[cH:23][c:24]([C:26]([F:27])([F:28])[F:29])[cH:25]1)([F:35])[F:36]>>[Cl:1][c:2]1[cH:3][c:4]([S:10][c:11]2[c:12]([Cl:17])[cH:13][cH:14][cH:15][cH:16]2)[c:5]([N:8]([CH3:9])[C:31]([CH:30]([c:22]2[cH:21][c:20]([C:19]([F:18])([F:35])[F:36])[cH:25][c:24]([C:26]([F:27])([F:28])[F:29])[cH:23]2)[CH3:34])=[O:33])[cH:6][cH:7]1

Participants

5

Reactant 4

HCID 111,2-DichloroethaneHCID 10868DicyclohexylcarbodiimideHCID 115220582-(3,5-Bis(trifluoromethyl)phenyl)propanoic acidHCID 181854001-Chloro-4-methylamino-3-(2-chloro-phenylsulfanyl)-benzene

Product 1

HCID 9807651(RS)-2-(3,5-Bis-trifluoromethyl-phenyl)-N-[4-chloro-2-(2-chloro-phenylsulfanyl)-phenyl]-N-methyl-propionamide

Sources & evidence

ORD record
ord-71468c0f2526470dbcbb1116250c99bc
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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