Potassium Cation → N-[1-[[2-[(5-bromo-6-fluoro-3-pyridinyl)amino]-3,4-dioxocyclobuten-1-yl]amino]-2,2-dimethylpropyl]-4-chlorobenzamide

HRID 1544676Notes

Reaction equation

HRID 1544676 reaction equation
[K+:41].[K+:42].[NH2:25][c:26]1[c:27](=[O:40])[c:28](=[O:39])[c:29]1[NH:30][c:31]1[cH:32][n:33][c:34]([F:38])[c:35]([Br:37])[cH:36]1.[O-:43][C:44]([O-:45])=[O:46].[n:1]1([CH:10]([C:11]([CH3:12])([CH3:13])[CH3:14])[NH:15][C:16]([c:17]2[cH:18][cH:19][c:20]([Cl:23])[cH:21][cH:22]2)=[O:24])[c:2]2[cH:3][cH:4][cH:5][cH:6][c:7]2[n:8][n:9]1>>[CH:10]([C:11]([CH3:12])([CH3:13])[CH3:14])([NH:15][C:16]([c:17]1[cH:18][cH:19][c:20]([Cl:23])[cH:21][cH:22]1)=[O:24])[NH:25][c:26]1[c:27](=[O:40])[c:28](=[O:39])[c:29]1[NH:30][c:31]1[cH:32][n:33][c:34]([F:38])[c:35]([Br:37])[cH:36]1

Participants

5

Reactant 4

HCID 813Potassium Cation2×HCID 19660Carbonate IonHCID 183796953-Amino-4-[(5-bromo-6-fluoro-3-pyridinyl)amino]cyclobut-3-ene-1,2-dioneHCID 18770523n-(1-(1h-1,2,3-Benzotriazol-1-yl)-2,2-dimethylpropyl)-4-chlorobenzamide

Product 1

HCID 10279164N-[1-[[2-[(5-bromo-6-fluoro-3-pyridinyl)amino]-3,4-dioxocyclobuten-1-yl]amino]-2,2-dimethylpropyl]-4-chlorobenzamide

Sources & evidence

ORD record
ord-da23a69974d04650bf58c8bd7d1ed60d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

Loading…