Chloride → HCID 50991219, compound

HRID 2153507Notes

Reaction equation

HRID 2153507 reaction equation
[CH3:16][O:17][c:18]1[n:19][c:20]([O:21][CH3:22])[n:23][c:24]([N+:25]2([CH3:26])[CH2:27][CH2:28][O:29][CH2:30][CH2:31]2)[n:32]1.[CH3:51][OH:52].[Cl-:15].[NH2:33][c:34]1[cH:35][cH:36][c:37]([F:48])[c:38]([C:40]2([CH3:47])[N:41]=[C:42]([NH2:46])[CH2:43][O:44][CH2:45]2)[cH:39]1.[Na+:50].[OH-:49].[OH2:14].[o:1]1[c:2](-[c:6]2[cH:7][c:8]([C:11](=[O:12])[OH:13])[n:9][o:10]2)[cH:3][cH:4][cH:5]1>>[o:1]1[c:2](-[c:6]2[cH:7][c:8]([C:11](=[O:13])[NH:33][c:34]3[cH:35][cH:36][c:37]([F:48])[c:38]([C:40]4([CH3:47])[N:41]=[C:42]([NH2:46])[CH2:43][O:44][CH2:45]4)[cH:39]3)[n:9][o:10]2)[cH:3][cH:4][cH:5]1

Participants

9

Reactant 8

HCID 312ChlorideHCID 887MethanolHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 10909825-(2-Furyl)isoxazole-3-carboxylic acidHCID 27340604-(4,6-Dimethoxy-1,3,5-triazin-2-yl)-4-methylmorpholin-4-iumHCID 58155285HCID 58155285, compound

Product 1

HCID 50991219HCID 50991219, compound

Sources & evidence

ORD record
ord-a605e29c21a94d489bcbb3766df66dab
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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