Sodium ion → HCID 15100973, compound

HRID 1114046Notes

Reaction equation

HRID 1114046 reaction equation
[CH3:1][N:2]1[CH2:3][CH2:4][NH:5][CH2:6][CH2:7]1.[CH3:41][c:42]1[cH:43][cH:44][cH:45][cH:46][cH:47]1.[Cl:8][CH2:9][C:10](=[O:11])[N:12]1[c:13]2[n:14]([n:28][cH:29][c:30]2[C:31]#[N:32])[C:15]([c:18]2[cH:19][c:20]([C:24]([F:25])([F:26])[F:27])[cH:21][cH:22][cH:23]2)=[CH:16][CH2:17]1.[Na+:33].[Na+:34].[Na+:40].[O-:35][C:36](=[O:37])[O-:38].[OH-:39]>>[CH3:1][N:2]1[CH2:3][CH2:4][N:5]([CH2:9][C:10](=[O:11])[N:12]2[c:13]3[n:14]([n:28][cH:29][c:30]3[C:31]#[N:32])[C:15]([c:18]3[cH:19][c:20]([C:24]([F:25])([F:26])[F:27])[cH:21][cH:22][cH:23]3)=[CH:16][CH2:17]2)[CH2:6][CH2:7]1

Participants

7

Reactant 6

HCID 923Sodium ion3×HCID 961HydroxideHCID 1140TolueneHCID 19660Carbonate IonHCID 531671-MethylpiperazineHCID 15100972HCID 15100972, compound

Product 1

HCID 15100973HCID 15100973, compound

Sources & evidence

ORD record
ord-71f40bf0779c4eb485a4e396eff1eadb
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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