Chloride → HCID 10380708, compound

HRID 90366Notes

Reaction equation

HRID 90366 reaction equation
[CH2:1]([CH3:2])[S:3][c:4]1[n:5][n:6][c:7](-[c:19]2[cH:20][cH:21][cH:22][cH:23][cH:24]2)[n:8]1[CH2:9][c:10]1[cH:11][cH:12][c:13]([N+:16]([O-:17])=[O:18])[cH:14][cH:15]1.[CH3:26][CH2:27][O:28][C:29](=[O:30])[CH3:31].[Cl-:25]>>[CH2:1]([CH3:2])[S:3][c:4]1[n:5][n:6][c:7](-[c:19]2[cH:20][cH:21][cH:22][cH:23][cH:24]2)[n:8]1[CH2:9][c:10]1[cH:11][cH:12][c:13]([NH2:16])[cH:14][cH:15]1

Participants

4

Reactant 3

HCID 312ChlorideHCID 8857Ethyl AcetateHCID 104499163-Ethylthio-4-(4-nitrobenzyl)-5-phenyl-4H-1,2,4-triazole

Product 1

HCID 10380708HCID 10380708, compound

Sources & evidence

ORD record
ord-eab8be3fd40b46d3b8468927c3d9eb19
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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