Sodium ion → HCID 15101024, compound

HRID 1555378Notes

Reaction equation

HRID 1555378 reaction equation
[CH2:22]([c:23]1[cH:24][cH:25][cH:26][cH:27][cH:28]1)[N:29]1[CH2:30][CH2:31][NH:32][CH2:33][CH2:34]1.[CH3:41][c:42]1[cH:43][cH:44][cH:45][cH:46][cH:47]1.[Cl:1][CH2:2][C:3](=[O:4])[N:5]1[c:6]2[n:7]([n:17][cH:18][c:19]2[C:20]#[N:21])[C:8]([c:11]2[cH:12][cH:13][cH:14][cH:15][cH:16]2)=[CH:9][CH2:10]1.[Na+:35].[Na+:36].[O-:37][C:38](=[O:39])[O-:40]>>[CH2:2]([C:3](=[O:4])[N:5]1[c:6]2[n:7]([n:17][cH:18][c:19]2[C:20]#[N:21])[C:8]([c:11]2[cH:12][cH:13][cH:14][cH:15][cH:16]2)=[CH:9][CH2:10]1)[N:32]1[CH2:31][CH2:30][N:29]([CH2:22][c:23]2[cH:24][cH:25][cH:26][cH:27][cH:28]2)[CH2:34][CH2:33]1

Participants

6

Reactant 5

HCID 923Sodium ion2×HCID 1140TolueneHCID 19660Carbonate IonHCID 759941-BenzylpiperazineHCID 19756218HCID 19756218, compound

Product 1

HCID 15101024HCID 15101024, compound

Sources & evidence

ORD record
ord-17853b0ed2884335923caf3c75b2dc0c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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