Water → HCID 19793500, compound

HRID 695462Notes

Reaction equation

HRID 695462 reaction equation
[CH2:1]([CH2:2][CH2:3][CH3:4])[c:5]1[n:6]([CH2:12][c:13]2[c:14]([Cl:19])[cH:15][cH:16][cH:17][cH:18]2)[c:7]([CH:10]=[O:11])[cH:8][n:9]1.[CH3:20][O:21][C:22]([CH:23]([NH2:24])[CH2:25][c:26]1[s:27][cH:28][cH:29][cH:30]1)=[O:31].[CH3:32][c:33]1[cH:34][cH:35][cH:36][cH:37][cH:38]1.[OH2:39]>>[CH2:1]([CH2:2][CH2:3][CH3:4])[c:5]1[n:6]([CH2:12][c:13]2[c:14]([Cl:19])[cH:15][cH:16][cH:17][cH:18]2)[c:7]([CH:10]=[N:24][CH:23]([C:22]([O:21][CH3:20])=[O:31])[CH2:25][c:26]2[s:27][cH:28][cH:29][cH:30]2)[cH:8][n:9]1

Participants

5

Reactant 4

HCID 962WaterHCID 1140TolueneHCID 101075301H-Imidazole-5-carboxaldehyde, 2-butyl-1-[(2-chlorophenyl)methyl]-HCID 13961460HCID 13961460, compound

Product 1

HCID 19793500HCID 19793500, compound

Sources & evidence

ORD record
ord-fe02b3207997461fa62ed890c9e2620f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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