Sodium ion → HCID 135816656, compound

HRID 2320524Notes

Reaction equation

HRID 2320524 reaction equation
[CH3:25][c:26]1[c:27](-[c:33]2[n:34][c:35](-[c:47]3[c:48]([OH:54])[cH:49][c:50]([OH:53])[cH:51][cH:52]3)[n:36][c:37](-[c:39]3[c:40]([CH3:46])[cH:41][c:42]([CH3:45])[cH:43][cH:44]3)[n:38]2)[cH:28][cH:29][c:30]([CH3:32])[cH:31]1.[CH3:57][N:58]([CH3:59])[CH:60]=[O:61].[Cl:1][CH2:2][C:3](=[O:4])[O:5][CH:6]1[CH2:7][C:8]([CH3:23])([CH3:24])[N:9]([O:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH3:22])[C:10]([CH3:12])([CH3:13])[CH2:11]1.[Na+:56].[OH-:55]>>[CH2:2]([C:3](=[O:4])[O:5][CH:6]1[CH2:7][C:8]([CH3:23])([CH3:24])[N:9]([O:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH3:22])[C:10]([CH3:12])([CH3:13])[CH2:11]1)[O:53][c:50]1[cH:49][c:48]([OH:54])[c:47](-[c:35]2[n:34][c:33](-[c:27]3[c:26]([CH3:25])[cH:31][c:30]([CH3:32])[cH:29][cH:28]3)[n:38][c:37](-[c:39]3[c:40]([CH3:46])[cH:41][c:42]([CH3:45])[cH:43][cH:44]3)[n:36]2)[cH:52][cH:51]1

Participants

6

Reactant 5

HCID 923Sodium ionHCID 961HydroxideHCID 6228DimethylformamideHCID 742762-(2,4-Dihydroxyphenyl)-4,6-bis(2,4-dimethylphenyl)-1,3,5-triazineHCID 19831361HCID 19831361, compound

Product 1

HCID 135816656HCID 135816656, compound

Sources & evidence

ORD record
ord-8b9e6ff1bdb4478ca65b8bcf1310aa22
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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