Sodium Ion → 1-(2-Chloro-4,5-difluorobenzoyl)-3-(5-amino-2-methoxyphenyl)urea

Reaction equation

[CH3:29][CH2:30][O:31][C:32](=[O:33])[CH3:34].[Cl:1][c:2]1[c:3]([C:4](=[O:5])[NH:6][C:7](=[O:8])[NH:9][c:10]2[c:11]([O:19][CH3:20])[cH:12][cH:13][c:14]([N+:16]([O-:17])=[O:18])[cH:15]2)[cH:21][c:22]([F:26])[c:23]([F:25])[cH:24]1.[Na+:28].[OH-:27]>>[Cl:1][c:2]1[c:3]([C:4](=[O:5])[NH:6][C:7](=[O:8])[NH:9][c:10]2[c:11]([O:19][CH3:20])[cH:12][cH:13][c:14]([NH2:16])[cH:15]2)[cH:21][c:22]([F:26])[c:23]([F:25])[cH:24]1

Participants

Reactant 4

HCID 923Sodium Ion

HCID 961Hydroxide

HCID 8857Ethyl Acetate

HCID 116681521-(2-Chloro4,5-difluorobenzoyl)-3-(2-methoxy-5-nitrophenyl)urea

Product 1

HCID 115665791-(2-Chloro-4,5-difluorobenzoyl)-3-(5-amino-2-methoxyphenyl)urea

Sources & evidence

ORD record: ord-fb2e4673601142d98a8fd1f7a8231fe5
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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