Sodium ion → 6-(3-Chloro-4-(4,5-dihydro-1H-imidazol-2-yl)phenyl)-2-(2-(7-methoxyquinolin-4-yloxy)ethyl)pyridazin-3(2H)-one

HRID 694726Notes

Reaction equation

HRID 694726 reaction equation
[Cl:36][Si:37]([CH3:38])([CH3:39])[CH3:40].[Cl:43][CH2:44][Cl:45].[I-:42].[NH2:1][CH2:2][CH2:3][NH:4][C:5]([c:6]1[c:7]([Cl:34])[cH:8][c:9](-[c:12]2[n:13][n:14]([CH2:19][CH2:20][O:21][c:22]3[cH:23][cH:24][n:25][c:26]4[cH:27][c:28]([O:32][CH3:33])[cH:29][cH:30][c:31]34)[c:15](=[O:18])[cH:16][cH:17]2)[cH:10][cH:11]1)=[O:35].[Na+:41]>>[N:1]1=[C:5]([c:6]2[c:7]([Cl:34])[cH:8][c:9](-[c:12]3[n:13][n:14]([CH2:19][CH2:20][O:21][c:22]4[cH:23][cH:24][n:25][c:26]5[cH:27][c:28]([O:32][CH3:33])[cH:29][cH:30][c:31]45)[c:15](=[O:18])[cH:16][cH:17]3)[cH:10][cH:11]2)[NH:4][CH2:3][CH2:2]1

Participants

6

Reactant 5

HCID 923Sodium ionHCID 6344DichloromethaneHCID 6397ChlorotrimethylsilaneHCID 30165Iodide IonHCID 59843092N-(2-aminoethyl)-2-chloro-4-(1-(2-(7-methoxyquinolin-4-yloxy)ethyl)-6-oxo-1,6-dihydropyridazin-3-yl)benzamide

Product 1

HCID 598430226-(3-Chloro-4-(4,5-dihydro-1H-imidazol-2-yl)phenyl)-2-(2-(7-methoxyquinolin-4-yloxy)ethyl)pyridazin-3(2H)-one

Sources & evidence

ORD record
ord-b62cb3fd703c4d0799119a2e66d470da
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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