Ammonium → 1-(2-(6-(4-oxazol-5-yl-phenoxy)-2-pyridin-2-yl-3-(2-trimethylsilanyl-ethoxymethyl)-3H-benzimidazol-5-yl)-pyrrolidin-1-yl)-ethanone

HRID 677465

Reaction equation

HRID 677465 reaction equation
[Br:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[cH:9][n:10][cH:11][o:12]2)[cH:6][cH:7]1.[C:13](=[O:14])([O-:15])[O-:16].[Cl-:51].[Cs+:17].[Cs+:18].[NH4+:52].[OH:19][c:20]1[c:21]([CH:43]2[N:44]([C:48]([CH3:49])=[O:50])[CH2:45][CH2:46][CH2:47]2)[cH:22][c:23]2[c:24]([n:25][c:26](-[c:36]3[n:37][cH:38][cH:39][cH:40][cH:41]3)[n:27]2[CH2:28][O:29][CH2:30][CH2:31][Si:32]([CH3:33])([CH3:34])[CH3:35])[cH:42]1.[cH:53]1[cH:54][cH:55][n:56][cH:57][cH:58]1>>[c:2]1([O:19][c:20]2[c:21]([CH:43]3[N:44]([C:48]([CH3:49])=[O:50])[CH2:45][CH2:46][CH2:47]3)[cH:22][c:23]3[c:24]([n:25][c:26](-[c:36]4[n:37][cH:38][cH:39][cH:40][cH:41]4)[n:27]3[CH2:28][O:29][CH2:30][CH2:31][Si:32]([CH3:33])([CH3:34])[CH3:35])[cH:42]2)[cH:3][cH:4][c:5](-[c:8]2[cH:9][n:10][cH:11][o:12]2)[cH:6][cH:7]1

Participants

8

Reactant 7

HCID 223AmmoniumHCID 312ChlorideHCID 1049PyridineHCID 19660Carbonate IonHCID 104967Cesium cation2×HCID 27764185-(4-Bromophenyl)-1,3-oxazoleHCID 231452771-(2-(6-hydroxy-2-pyridin-2-yl-3-(2-trimethylsilanyl-ethoxymethyl)-3H-benzimidazol-5-yl)-pyrrolidin-1-yl)-ethanone

Product 1

HCID 231453191-(2-(6-(4-oxazol-5-yl-phenoxy)-2-pyridin-2-yl-3-(2-trimethylsilanyl-ethoxymethyl)-3H-benzimidazol-5-yl)-pyrrolidin-1-yl)-ethanone

Sources & evidence

ORD record
ord-c86630a67ccb4c7ba7b9f62f54d0dd8f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Linked notes

Loading…