Sodium ion → HCID 178464192, compound

HRID 2317667Notes

Reaction equation

HRID 2317667 reaction equation
[CH3:1][CH:2]1[N:3]([CH:9]([c:10]2[cH:11][c:12]([O:16][CH3:17])[cH:13][cH:14][cH:15]2)[c:18]2[cH:19][c:20]([C:21](=[O:22])[N:23]([CH2:24][CH3:25])[CH2:26][CH3:27])[cH:28][cH:29][cH:30]2)[CH2:4][CH:5]([CH3:8])[NH:6][CH2:7]1.[CH3:48][C:49]#[N:50].[F:39][c:40]1[cH:41][c:42]([CH2:43][Br:44])[cH:45][cH:46][cH:47]1.[I-:32].[Na+:31].[Na+:33].[Na+:34].[O-:35][C:36](=[O:37])[O-:38]>>[CH3:1][CH:2]1[N:3]([CH:9]([c:10]2[cH:11][c:12]([O:16][CH3:17])[cH:13][cH:14][cH:15]2)[c:18]2[cH:19][c:20]([C:21](=[O:22])[N:23]([CH2:24][CH3:25])[CH2:26][CH3:27])[cH:28][cH:29][cH:30]2)[CH2:4][CH:5]([CH3:8])[N:6]([CH2:43][c:42]2[cH:41][c:40]([F:39])[cH:47][cH:46][cH:45]2)[CH2:7]1

Participants

7

Reactant 6

HCID 923Sodium ion3×HCID 6342AcetonitrileHCID 19660Carbonate IonHCID 30165Iodide IonHCID 680073-Fluorobenzyl bromideHCID 178464191HCID 178464191, compound

Product 1

HCID 178464192HCID 178464192, compound

Sources & evidence

ORD record
ord-c2fe1fef5eba4099bbb3b41ac2e2cf88
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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