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Acetate → 1-Ethyl-3-[5-(1-methoxyimino-butyl)-7-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridine-2-yl]-urea

HRID 101344
Notes
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Reaction equation

HRID 101344 reaction equation
[C:1]([CH2:2][CH2:3][CH3:4])(=[O:5])[c:6]1[cH:7][c:8](-[c:21]2[cH:22][n:23][cH:24][cH:25][cH:26]2)[cH:9][c:10]2[n:11]1[n:12][c:13]([NH:15][C:16](=[O:17])[NH:18][CH2:19][CH3:20])[n:14]2.[C:34]([O-:35])(=[O:36])[CH3:37].[CH3:27][O:28][NH2:29].[CH3:39][CH2:40][OH:41].[ClH:30].[Na+:38].[OH2:31].[OH2:32].[OH2:33]>>[C:1]([CH2:2][CH2:3][CH3:4])([c:6]1[cH:7][c:8](-[c:21]2[cH:22][n:23][cH:24][cH:25][cH:26]2)[cH:9][c:10]2[n:11]1[n:12][c:13]([NH:15][C:16](=[O:17])[NH:18][CH2:19][CH3:20])[n:14]2)=[N:29][O:28][CH3:27]
ParticipantsSources & evidenceReaction notes

Participants

8

Reactant 7

HCID 175AcetateHCID 313Hydrochloric AcidHCID 702EthanolHCID 923Sodium IonHCID 962Water3×HCID 4113O-MethylhydroxylamineHCID 688353671-(5-Butyryl-7-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)-3-ethyl-urea

Product 1

HCID 866180241-Ethyl-3-[5-(1-methoxyimino-butyl)-7-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridine-2-yl]-urea

Sources & evidence

ORD record
ord-9f7b1f01912f40a99aaab6858df5d163
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes