Imidazole → HCID 13073921, compound

HRID 2325850Notes

Reaction equation

HRID 2325850 reaction equation
[CH3:45][N:46]([CH3:47])[CH:48]=[O:49].[Cl:8][c:9]1[cH:10][cH:11][c:12]([CH:15]([c:16]2[c:17]([Cl:23])[cH:18][c:19]([Cl:22])[cH:20][cH:21]2)[O:24][CH:25]2[CH2:26][CH2:27][CH2:28][CH:29]([CH2:31][O:32][S:33]([c:34]3[cH:35][cH:36][c:37]([CH3:38])[cH:39][cH:40]3)(=[O:41])=[O:42])[O:30]2)[cH:13][cH:14]1.[H-:1].[I-:44].[Na+:2].[Na+:43].[OH2:50].[nH:3]1[cH:4][n:5][cH:6][cH:7]1>>[n:3]1([CH2:31][CH:29]2[CH2:28][CH2:27][CH2:26][CH:25]([O:24][CH:15]([c:12]3[cH:11][cH:10][c:9]([Cl:8])[cH:14][cH:13]3)[c:16]3[c:17]([Cl:23])[cH:18][c:19]([Cl:22])[cH:20][cH:21]3)[O:30]2)[cH:4][n:5][cH:6][cH:7]1

Participants

8

Reactant 7

HCID 795ImidazoleHCID 923Sodium ion2×HCID 962WaterHCID 6228DimethylformamideHCID 30165Iodide IonHCID 166653HydrideHCID 20476908HCID 20476908, compound

Product 1

HCID 13073921HCID 13073921, compound

Sources & evidence

ORD record
ord-4e346774b329445887410a80b4351458
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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