HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.8.0
  1. Home
  2. /Reaction

Sodium Ion → 2-(3-Methoxy-5-{methyl-[2-methyl-6-(4-trifluoromethyl-phenyl)-pyridin-3-ylmethyl]-carbamoyl}-phenoxy)-2-methyl-propionic acid ethyl ester

HRID 106160
Notes
Print preview

Reaction equation

HRID 106160 reaction equation
[CH2:21]([CH3:22])[O:23][C:24](=[O:25])[C:26]([CH3:27])([O:28][c:29]1[cH:30][c:31]([C:32](=[O:33])[OH:34])[cH:35][c:36]([O:38][CH3:39])[cH:37]1)[CH3:40].[CH2:52]([CH2:53][C:54]([Br:55])([CH3:56])[C:57]([O-:58])=[O:59])[CH3:60].[CH3:1][NH:2][CH2:3][c:4]1[c:5]([CH3:20])[n:6][c:7](-[c:10]2[cH:11][cH:12][c:13]([C:16]([F:17])([F:18])[F:19])[cH:14][cH:15]2)[cH:8][cH:9]1.[Cl+:61]([O-:62])[O-:63].[Na+:64].[OH:41][c:42]1[cH:43][c:44]([CH:50]=[O:51])[cH:45][c:46]([O:47][CH3:48])[cH:49]1>>[CH3:1][N:2]([CH2:3][c:4]1[c:5]([CH3:20])[n:6][c:7](-[c:10]2[cH:11][cH:12][c:13]([C:16]([F:17])([F:18])[F:19])[cH:14][cH:15]2)[cH:8][cH:9]1)[C:32]([c:31]1[cH:30][c:29]([O:28][C:26]([C:24]([O:23][CH2:21][CH3:22])=[O:25])([CH3:27])[CH3:40])[cH:37][c:36]([O:38][CH3:39])[cH:35]1)=[O:34]
ParticipantsSources & evidenceReaction notes

Participants

7

Reactant 6

HCID 923Sodium IonHCID 197148ChloriteHCID 53145613-Hydroxy-5-methoxybenzaldehydeHCID 219358253-(1-Ethoxycarbonyl-1-methyl-ethoxy)-5-methoxy-benzoic acidHCID 21935851Methyl-[2-methyl-6-(4-trifluoromethyl-phenyl)-pyridin-3-ylmethyl]-amineHCID 22490247Ethyl-bromoisobutyrate

Product

1
HCID 670725072-(3-Methoxy-5-{methyl-[2-methyl-6-(4-trifluoromethyl-phenyl)-pyridin-3-ylmethyl]-carbamoyl}-phenoxy)-2-methyl-propionic acid ethyl ester

Sources & evidence

ORD record
ord-ff7a90e71d8b43b9b6aeedd4ea72de1c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

Reaction notes

Loading…

On this pageParticipantsSources & evidenceReaction notes