Ethyl Acetate → 1H-Imidazole-2-ethanol, 1-((4-aminophenyl)methyl)-5-((3,5-dichlorophenyl)thio)-4-(1-methylethyl)-, carbamate (ester)

HRID 2133902Notes

Reaction equation

HRID 2133902 reaction equation
[C:1]([NH2:2])(=[O:3])[O:4][CH2:5][CH2:6][c:7]1[n:8]([CH2:24][c:25]2[cH:26][cH:27][c:28]([N+:31]([O-:32])=[O:33])[cH:29][cH:30]2)[c:9]([S:15][c:16]2[cH:17][c:18]([Cl:23])[cH:19][c:20]([Cl:22])[cH:21]2)[c:10]([CH:12]([CH3:13])[CH3:14])[n:11]1.[CH3:36][CH2:37][O:38][C:39](=[O:40])[CH3:41].[H:34][H:35]>>[C:1]([NH2:2])(=[O:3])[O:4][CH2:5][CH2:6][c:7]1[n:8]([CH2:24][c:25]2[cH:26][cH:27][c:28]([NH2:31])[cH:29][cH:30]2)[c:9]([S:15][c:16]2[cH:17][c:18]([Cl:23])[cH:19][c:20]([Cl:22])[cH:21]2)[c:10]([CH:12]([CH3:13])[CH3:14])[n:11]1

Participants

4

Reactant 3

HCID 8857Ethyl AcetateHCID 4740691H-Imidazole-2-ethanol, 5-((3,5-dichlorophenyl)thio)-4-(1-methylethyl)-1-((4-nitrophenyl)methyl)-, carbamate (ester)HCID 178418361HCID 178418361, compound

Product 1

HCID 4740701H-Imidazole-2-ethanol, 1-((4-aminophenyl)methyl)-5-((3,5-dichlorophenyl)thio)-4-(1-methylethyl)-, carbamate (ester)

Sources & evidence

ORD record
ord-e2e111ac59d54f5ab23e5f3ef3858c72
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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