Potassium Cation → 3,5-dichloro-N-[1-[[2-[(2-chloro-3-pyridinyl)amino]-3,4-dioxocyclobuten-1-yl]amino]-2,2-dimethylpropyl]benzamide

HRID 1130328Notes

Reaction equation

HRID 1130328 reaction equation
[K+:41].[K+:42].[NH2:1][c:2]1[c:3](=[O:15])[c:4](=[O:14])[c:5]1[NH:6][c:7]1[c:8]([Cl:13])[n:9][cH:10][cH:11][cH:12]1.[O-:43][C:44]([O-:45])=[O:46].[n:16]1([CH:25]([C:26]([CH3:27])([CH3:28])[CH3:29])[NH:30][C:31]([c:32]2[cH:33][c:34]([Cl:39])[cH:35][c:36]([Cl:38])[cH:37]2)=[O:40])[c:17]2[cH:18][cH:19][cH:20][cH:21][c:22]2[n:23][n:24]1>>[NH:1]([c:2]1[c:3](=[O:15])[c:4](=[O:14])[c:5]1[NH:6][c:7]1[c:8]([Cl:13])[n:9][cH:10][cH:11][cH:12]1)[CH:25]([C:26]([CH3:27])([CH3:28])[CH3:29])[NH:30][C:31]([c:32]1[cH:33][c:34]([Cl:39])[cH:35][c:36]([Cl:38])[cH:37]1)=[O:40]

Participants

5

Reactant 4

HCID 813Potassium Cation2×HCID 19660Carbonate IonHCID 18379714N-(1-(1H-1,2,3-Benzotriazol-1-yl)-2,2-dimethylpropyl)-3,5-dichlorobenzamideHCID 183797593-Amino-4-[(2-chloro-3-pyridinyl)amino]cyclobut-3-ene-1,2-dione

Product 1

HCID 101407393,5-dichloro-N-[1-[[2-[(2-chloro-3-pyridinyl)amino]-3,4-dioxocyclobuten-1-yl]amino]-2,2-dimethylpropyl]benzamide

Sources & evidence

ORD record
ord-c2c9e42a0d9d4eeb84f65f73e35a0392
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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