Toluene → N-(4-Cyclopropylphenyl)-2-((3,5-dichloropyridin-4-yl)amino)-1,7,7-trimethyl-7,8-dihydro-1H-benzofuro[4,5-d]imidazole-5-carboxamide

HRID 1115293Notes

Reaction equation

HRID 1115293 reaction equation
[CH3:39][Al:40]([CH3:41])[CH3:42].[CH3:43][c:44]1[cH:45][cH:46][cH:47][cH:48][cH:49]1.[CH:29]1([c:32]2[cH:33][cH:34][c:35]([NH2:36])[cH:37][cH:38]2)[CH2:30][CH2:31]1.[Cl:1][c:2]1[cH:3][n:4][cH:5][c:6]([Cl:28])[c:7]1[NH:8][c:9]1[n:10][c:11]2[c:12]([n:13]1[CH3:14])[c:15]1[c:19]([c:20]([C:22]([O:24][CH3:23])=[O:25])[cH:21]2)[O:18][C:17]([CH3:26])([CH3:27])[CH2:16]1>>[Cl:1][c:2]1[cH:3][n:4][cH:5][c:6]([Cl:28])[c:7]1[NH:8][c:9]1[n:10][c:11]2[c:12]([n:13]1[CH3:14])[c:15]1[c:19]([c:20]([C:22](=[O:24])[NH:36][c:35]3[cH:34][cH:33][c:32]([CH:29]4[CH2:30][CH2:31]4)[cH:38][cH:37]3)[cH:21]2)[O:18][C:17]([CH3:26])([CH3:27])[CH2:16]1

Participants

5

Reactant 4

HCID 1140TolueneHCID 122539274-CyclopropylanilineHCID 16682925TrimethylaluminumHCID 67502200Methyl 2-((3,5-dichloropyridin-4-yl)amino)-1,7,7-trimethyl-7,8-dihydro-1H-benzofuro[4,5-d]imidazole-5-carboxylate

Product 1

HCID 56968488N-(4-Cyclopropylphenyl)-2-((3,5-dichloropyridin-4-yl)amino)-1,7,7-trimethyl-7,8-dihydro-1H-benzofuro[4,5-d]imidazole-5-carboxamide

Sources & evidence

ORD record
ord-4412a6cbe69547198c9854e93853e001
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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