Water → (2-Chloro-5-methyl-pyridin-3-yl)-[2-(4-fluoro-phenyl)-1-pyridin-4-yl-ethylidene]-amine

HRID 192517Notes

Reaction equation

HRID 192517 reaction equation
[CH3:28][c:29]1[cH:30][c:31]([NH2:36])[c:32]([Cl:35])[n:33][cH:34]1.[CH3:45][c:46]1[cH:47][cH:48][cH:49][cH:50][cH:51]1.[F:12][c:13]1[cH:14][cH:15][c:16]([CH2:19][C:20](=[O:21])[c:22]2[cH:23][cH:24][n:25][cH:26][cH:27]2)[cH:17][cH:18]1.[OH2:44].[c:1]1([CH3:2])[cH:3][cH:4][c:5]([S:6]([OH:7])(=[O:8])=[O:9])[cH:10][cH:11]1.[c:37]1([CH3:38])[cH:39][cH:40][cH:41][cH:42][cH:43]1>>[F:12][c:13]1[cH:14][cH:15][c:16]([CH2:19][C:20]([c:22]2[cH:23][cH:24][n:25][cH:26][cH:27]2)=[N:36][c:31]2[cH:30][c:29]([CH3:28])[cH:34][n:33][c:32]2[Cl:35])[cH:17][cH:18]1

Participants

6

Reactant 5

HCID 962WaterHCID 1140Toluene2×HCID 6101p-Toluenesulfonic acidHCID 27344222-Chloro-5-methylpyridin-3-amineHCID 110421332-(4-Fluorophenyl)-1-(pyridin-4-yl)ethanone

Product 1

HCID 86643497(2-Chloro-5-methyl-pyridin-3-yl)-[2-(4-fluoro-phenyl)-1-pyridin-4-yl-ethylidene]-amine

Sources & evidence

ORD record
ord-4733989af3a24100840c75346c498eae
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

Loading…