Sodium Ion → 2-t-butyl-4-methyl-5-(p-phenyl-benzylthio)-3(2H)-pyridazinone

Reaction equation

[C:17]([CH3:18])([CH3:19])([CH3:20])[n:21]1[n:22][cH:23][c:24]([Cl:29])[c:25]([CH3:28])[c:26]1=[O:27].[CH3:31][N:32]([CH3:33])[CH:34]=[O:35].[H-:1].[Na+:2].[OH2:30].[c:3]1(-[c:9]2[cH:10][cH:11][c:12]([CH2:13][SH:14])[cH:15][cH:16]2)[cH:4][cH:5][cH:6][cH:7][cH:8]1>>[c:3]1(-[c:9]2[cH:10][cH:11][c:12]([CH2:13][S:14][c:24]3[cH:23][n:22][n:21]([C:17]([CH3:18])([CH3:19])[CH3:20])[c:26](=[O:27])[c:25]3[CH3:28])[cH:15][cH:16]2)[cH:4][cH:5][cH:6][cH:7][cH:8]1

Participants

Reactant 6

HCID 923Sodium Ion

HCID 962Water

HCID 6228Dimethylformamide

HCID 166653Hydride

HCID 138222642-tert-butyl-5-chloro-4-methylpyridazin-3-(2H)-one

HCID 15147117(1,1'-Biphenyl)-4-methanethiol

Product 1

HCID 138250992-t-butyl-4-methyl-5-(p-phenyl-benzylthio)-3(2H)-pyridazinone

Sources & evidence

ORD record: ord-6d4b7095dbc142c1975aa495dfed38e1
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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