Acetate → HCID 136155039, compound

HRID 175345Notes

Reaction equation

HRID 175345 reaction equation
[CH3:23][C:24](=[O:25])[O-:26].[CH3:29][CH2:30][OH:31].[ClH:11].[ClH:27].[N:7]([O-:8])=[O:9].[NH2:12][c:13]1[cH:14][c:15](=[O:21])[n:16]2[n:17]1[CH2:18][CH2:19][CH2:20]2.[NH2:1][c:2]1[s:3][cH:4][cH:5][n:6]1.[Na+:10].[Na+:22].[OH2:28]>>[N:1]([c:2]1[s:3][cH:4][cH:5][n:6]1)=[N:7][c:14]1[c:13]([NH2:12])[n:17]2[n:16]([c:15]1=[O:21])[CH2:20][CH2:19][CH2:18]2

Participants

9

Reactant 8

HCID 175AcetateHCID 313Hydrochloric Acid2×HCID 702EthanolHCID 923Sodium ion2×HCID 946NitriteHCID 962WaterHCID 21552-AminothiazoleHCID 11206081HCID 11206081, compound

Product 1

HCID 136155039HCID 136155039, compound

Sources & evidence

ORD record
ord-cf7dfa08734e4c45ac7e92d2f8cc30f3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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