Sodium ion → N-[6-(5-chloro-2-thienyl)-1,3-benzothiazol-2-yl]-N'-ethylurea

HRID 1572207Notes

Reaction equation

HRID 1572207 reaction equation
[Br:1][c:2]1[cH:3][c:4]2[c:5]([n:6][c:7]([NH:9][C:10](=[O:11])[NH:12][CH2:13][CH3:14])[s:8]2)[cH:15][cH:16]1.[CH3:17][O:18][CH2:19][CH2:20][O:21][CH3:22].[Cl:23][c:24]1[cH:25][cH:26][c:27]([B:29]([OH:30])[OH:31])[s:28]1.[Na+:32].[Na+:33].[O-:34][C:35](=[O:36])[O-:37].[OH2:38]>>[c:2]1(-[c:27]2[cH:26][cH:25][c:24]([Cl:23])[s:28]2)[cH:3][c:4]2[c:5]([n:6][c:7]([NH:9][C:10](=[O:11])[NH:12][CH2:13][CH3:14])[s:8]2)[cH:15][cH:16]1

Participants

7

Reactant 6

HCID 923Sodium ion2×HCID 962WaterHCID 80711,2-DimethoxyethaneHCID 19660Carbonate IonHCID 27343245-Chlorothiophene-2-boronic acidHCID 219855641-(6-Bromo-2-benzothiazolyl)-3-ethylurea

Product 1

HCID 21985583N-[6-(5-chloro-2-thienyl)-1,3-benzothiazol-2-yl]-N'-ethylurea

Sources & evidence

ORD record
ord-4ab07698df11415fab2d3ef03187105c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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