Ammonium → HCID 68760232, compound

HRID 1130400Notes

Reaction equation

HRID 1130400 reaction equation
[Cl-:57].[Cl:1][c:2]1[c:3]([OH:20])[c:4]2[c:5]([n:6][cH:7]1)[n:8]([CH2:11][c:12]1[cH:13][cH:14][c:15]([O:18][CH3:19])[cH:16][cH:17]1)[n:9][cH:10]2.[F:23][C:24]([F:25])([F:26])[S:27]([N:28]([c:29]1[cH:30][cH:31][cH:32][cH:33][cH:34]1)[S:35]([C:36]([F:37])([F:38])[F:39])(=[O:40])=[O:41])(=[O:42])=[O:43].[H-:21].[N:44]1([C:50](=[O:51])[O:52][C:53]([CH3:54])([CH3:55])[CH3:56])[CH2:45][CH2:46][NH:47][CH2:48][CH2:49]1.[NH4+:58].[Na+:22].[O:59]=[CH:60][N:61]([CH3:62])[CH3:63].[OH2:64]>>[Cl:1][c:2]1[c:3]([N:47]2[CH2:46][CH2:45][N:44]([C:50](=[O:51])[O:52][C:53]([CH3:54])([CH3:55])[CH3:56])[CH2:49][CH2:48]2)[c:4]2[c:5]([n:6][cH:7]1)[n:8]([CH2:11][c:12]1[cH:13][cH:14][c:15]([O:18][CH3:19])[cH:16][cH:17]1)[n:9][cH:10]2

Participants

10

Reactant 9

HCID 223AmmoniumHCID 312ChlorideHCID 923Sodium ionHCID 962WaterHCID 6228DimethylformamideHCID 142176Phenyl triflimideHCID 143452tert-Butyl piperazine-1-carboxylateHCID 166653HydrideHCID 178490903HCID 178490903, compound

Product 1

HCID 68760232HCID 68760232, compound

Sources & evidence

ORD record
ord-d706b4b32e14408ea5d563786ec1421c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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