Sodium ion → HCID 13633449, compound

HRID 1203968Notes

Reaction equation

HRID 1203968 reaction equation
[Br:21][CH2:22][CH2:23][n:24]1[c:25](=[O:33])[nH:26][c:27]2[c:28]1[cH:29][cH:30][cH:31][cH:32]2.[CH2:42]([C:43]([CH3:44])=[O:45])[CH:46]([CH3:47])[CH3:48].[I-:41].[Na+:34].[Na+:35].[Na+:40].[O-:36][C:37](=[O:38])[O-:39].[c:1]1([C:7]([OH:8])([CH:9]2[CH2:10][CH2:11][NH:12][CH2:13][CH2:14]2)[c:15]2[cH:16][cH:17][cH:18][cH:19][cH:20]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([C:7]([OH:8])([CH:9]2[CH2:10][CH2:11][N:12]([CH2:22][CH2:23][n:24]3[c:25](=[O:33])[nH:26][c:27]4[c:28]3[cH:29][cH:30][cH:31][cH:32]4)[CH2:13][CH2:14]2)[c:15]2[cH:16][cH:17][cH:18][cH:19][cH:20]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

7

Reactant 6

HCID 923Sodium ion3×HCID 7909Methyl Isobutyl KetoneHCID 15723AzacyclonolHCID 19660Carbonate IonHCID 30165Iodide IonHCID 136334481-(2-Bromoethyl)-1,3-dihydro-2H-benzimidazol-2-one

Product 1

HCID 13633449HCID 13633449, compound

Sources & evidence

ORD record
ord-38ed57e2238d4499940b71dbe5a713b0
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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