Ammonium → 1-[2-[[4-(5-Amino-1-benzothiophen-2-yl)-5-(trifluoromethyl)pyrimidin-2-yl]amino]ethyl]-5,5-dimethylimidazolidine-2,4-dione

HRID 156263

Reaction equation

HRID 156263 reaction equation
[CH3:1][C:2]1([CH3:34])[C:3](=[O:33])[NH:4][C:5](=[O:32])[N:6]1[CH2:7][CH2:8][NH:9][c:10]1[n:11][cH:12][c:13]([C:28]([F:29])([F:30])[F:31])[c:14](-[c:16]2[cH:17][c:18]3[c:19]([s:20]2)[cH:21][cH:22][c:23]([N+:25]([O-:26])=[O:27])[cH:24]3)[n:15]1.[CH3:38][CH2:39][OH:40].[Cl-:36].[In:35].[NH4+:37]>>[CH3:1][C:2]1([CH3:34])[C:3](=[O:33])[NH:4][C:5](=[O:32])[N:6]1[CH2:7][CH2:8][NH:9][c:10]1[n:11][cH:12][c:13]([C:28]([F:29])([F:30])[F:31])[c:14](-[c:16]2[cH:17][c:18]3[c:19]([s:20]2)[cH:21][cH:22][c:23]([NH2:25])[cH:24]3)[n:15]1

Participants

6

Reactant 5

HCID 223AmmoniumHCID 312ChlorideHCID 702EthanolHCID 5359967IndiumHCID 602046395,5-Dimethyl-1-[2-[[4-(5-nitro-1-benzothiophen-2-yl)-5-(trifluoromethyl)pyrimidin-2-yl]amino]ethyl]imidazolidine-2,4-dione

Product 1

HCID 602046361-[2-[[4-(5-Amino-1-benzothiophen-2-yl)-5-(trifluoromethyl)pyrimidin-2-yl]amino]ethyl]-5,5-dimethylimidazolidine-2,4-dione

Sources & evidence

ORD record
ord-6e920bace5d44ca4921c27204351bd96
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Linked notes

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