Bromide ion → Bromide ion

HRID 1140134Notes

Reaction equation

HRID 1140134 reaction equation
[Br-:1].[CH3:35][CH2:36][OH:37].[NH2:2][c:3]1[c:4]([C:11](=[O:12])[NH:13][CH2:14][CH2:15][N+:16]([CH3:17])([CH3:18])[CH2:19][CH2:20][N:21]2[C:22](=[O:23])[c:24]3[c:25]([cH:26][cH:27][cH:28][cH:29]3)[C:30]2=[O:31])[n:5][c:6]([Cl:10])[c:7]([NH2:9])[n:8]1.[NH2:33][NH2:34].[OH2:32]>>[Br-:1].[NH2:2][c:3]1[c:4]([C:11](=[O:12])[NH:13][CH2:14][CH2:15][N+:16]([CH3:17])([CH3:18])[CH2:19][CH2:20][NH2:21])[n:5][c:6]([Cl:10])[c:7]([NH2:9])[n:8]1

Participants

7

Reactant 5

HCID 259Bromide ionHCID 702EthanolHCID 962WaterHCID 9321HydrazineHCID 866566622-[(3,5-Diamino-6-chloropyrazine-2-carbonyl)amino]ethyl-[2-(1,3-dioxoisoindol-2-yl)ethyl]-dimethylazanium

Product 2

HCID 259Bromide ionHCID 866566482-Aminoethyl-[2-[(3,5-diamino-6-chloropyrazine-2-carbonyl)amino]ethyl]-dimethylazanium

Sources & evidence

ORD record
ord-bc442949f2904c8db58ce303c67c7d0f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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