Trifluoroacetic acid → HCID 178466505, compound

HRID 2157596Notes

Reaction equation

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

Participants

Reactant 3

HCID 6422Trifluoroacetic acid

HCID 28270625HCID 28270625, compound

HCID 72455749rac-(4S*,5R*)-4,5-Bis-(4-chloro-phenyl)-2-[4-(cyano-dimethyl-methyl)-2-ethoxy-phenyl]-4,5-dimethyl-4,5-dihydro-imidazole-1-carbonyl chloride

Product 1

HCID 178466505HCID 178466505, compound

Sources & evidence

ORD record: ord-3f08c0e1b824410697831a9879df270c
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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