Dimethylformamide → HCID 16065814, compound

HRID 2322009Notes

Reaction equation

HRID 2322009 reaction equation
[CH3:68][N:69]([CH2:70][CH2:71][NH2:72])[CH3:73].[CH:59]([N:60]([CH2:61][CH3:62])[CH:63]([CH3:64])[CH3:65])([CH3:66])[CH3:67].[Cl:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([C:15](=[O:16])[N:17]3[CH2:18][CH2:19][C:20]4([C:21](=[O:32])[N:22]([CH3:31])[CH2:23][N:24]4[c:25]4[cH:26][cH:27][cH:28][cH:29][cH:30]4)[CH2:33][CH2:34]3)[cH:7][n:8]([CH2:11][C:12](=[O:13])[OH:14])[c:9]2[cH:10]1.[O:74]=[CH:75][N:76]([CH3:77])[CH3:78].[P-:35]([F:36])([F:37])([F:38])([F:39])([F:40])[F:41].[n:42]1([O:43][C:44]([N:45]([CH3:46])[CH3:47])=[N+:48]([CH3:49])[CH3:50])[c:51]2[n:52][cH:53][cH:54][cH:55][c:56]2[n:57][n:58]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([C:15](=[O:16])[N:17]3[CH2:18][CH2:19][C:20]4([C:21](=[O:32])[N:22]([CH3:31])[CH2:23][N:24]4[c:25]4[cH:26][cH:27][cH:28][cH:29][cH:30]4)[CH2:33][CH2:34]3)[cH:7][n:8]([CH2:11][C:12](=[O:14])[NH:72][CH2:71][CH2:70][N:69]([CH3:68])[CH3:73])[c:9]2[cH:10]1

Participants

7

Reactant 6

HCID 6228DimethylformamideHCID 9886HexafluorophosphateHCID 66053N,N-DimethylethylenediamineHCID 81531DiisopropylethylamineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 68500278HCID 68500278, compound

Product 1

HCID 16065814HCID 16065814, compound

Sources & evidence

ORD record
ord-451a8132513a4d2aa88f9d8ba70120ee
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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