Sodium ion → [5-(3-Chloro-phenyl)-[1,2,4]oxadiazol-3-ylmethyl]-methyl-(4-methyl-5-pyridin-4-yl-4H-[1,2,4]triazol-3-yl)-amine

HRID 1117212Notes

Reaction equation

HRID 1117212 reaction equation
[CH3:3][NH:4][c:5]1[n:6][n:7][c:8](-[c:11]2[cH:12][cH:13][n:14][cH:15][cH:16]2)[n:9]1[CH3:10].[Cl:17][CH2:18][c:19]1[n:20][o:21][c:22](-[c:24]2[cH:25][c:26]([Cl:30])[cH:27][cH:28][cH:29]2)[n:23]1.[H-:2].[Na+:1].[O:31]=[CH:32][N:33]([CH3:34])[CH3:35]>>[CH3:3][N:4]([c:5]1[n:6][n:7][c:8](-[c:11]2[cH:12][cH:13][n:14][cH:15][cH:16]2)[n:9]1[CH3:10])[CH2:18][c:19]1[n:20][o:21][c:22](-[c:24]2[cH:25][c:26]([Cl:30])[cH:27][cH:28][cH:29]2)[n:23]1

Participants

6

Reactant 5

HCID 923Sodium ionHCID 6228DimethylformamideHCID 166653HydrideHCID 100825203-(Chloromethyl)-5-(3-chlorophenyl)-1,2,4-oxadiazoleHCID 57837980Methyl-(4-methyl-5-pyridin-4-yl4H-[1,2,4]triazol-3-yl)-amine

Product 1

HCID 67070962[5-(3-Chloro-phenyl)-[1,2,4]oxadiazol-3-ylmethyl]-methyl-(4-methyl-5-pyridin-4-yl-4H-[1,2,4]triazol-3-yl)-amine

Sources & evidence

ORD record
ord-ae248f6bd2bb4a12966b5187a61c2a76
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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