Acetone → HCID 23349974, compound

HRID 178834Notes

Reaction equation

HRID 178834 reaction equation
[Br:6][CH:7]([C:8]([C:9]([CH3:10])([CH3:11])[O:12][CH3:13])=[O:14])[O:15][c:16]1[c:17]([Cl:23])[cH:18][c:19]([Cl:22])[cH:20][cH:21]1.[CH3:35][C:36](=[O:37])[CH3:38].[N:24]12[CH2:25][CH2:26][CH2:27][CH2:28][CH:29]1[CH:30]=[N:31][CH2:32][CH2:33][CH2:34]2.[nH:1]1[n:2][cH:3][n:4][cH:5]1>>[n:1]1([CH:7]([C:8]([C:9]([CH3:10])([CH3:11])[O:12][CH3:13])=[O:14])[O:15][c:16]2[c:17]([Cl:23])[cH:18][c:19]([Cl:22])[cH:20][cH:21]2)[n:2][cH:3][n:4][cH:5]1

Participants

5

Reactant 4

HCID 180AcetoneHCID 92571H-1,2,4-TriazoleHCID 3141121,5-Diazabicyclo(5,4,0)undec-5-eneHCID 23349975HCID 23349975, compound

Product 1

HCID 23349974HCID 23349974, compound

Sources & evidence

ORD record
ord-803b7aa595294ab5ac67518fc3c50d91
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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