Dimethylformamide → HCID 57505777, compound

HRID 2134766Notes

Reaction equation

HRID 2134766 reaction equation
[CH3:70][N:71]([CH3:72])[CH:73]=[O:74].[CH:1]1([C:4](=[O:5])[NH:6][c:7]2[n:8][c:9]3[n:10]([n:11][c:12]([S:15][c:16]4[c:17]([C:18](=[O:19])[OH:20])[cH:21][cH:22][cH:23][cH:24]4)[cH:13][cH:14]3)[cH:25]2)[CH2:2][CH2:3]1.[CH:61]([N:62]([CH2:63][CH3:64])[CH:65]([CH3:66])[CH3:67])([CH3:68])[CH3:69].[F:26][C:27]([c:28]1[cH:29][cH:30][c:31]([NH2:32])[cH:33][cH:34]1)([F:35])[F:36].[P-:37]([F:38])([F:39])([F:40])([F:41])([F:42])[F:43].[n:44]1([O:45][C:46]([N:47]([CH3:48])[CH3:49])=[N+:50]([CH3:51])[CH3:52])[c:53]2[n:54][cH:55][cH:56][cH:57][c:58]2[n:59][n:60]1>>[CH:1]1([C:4](=[O:5])[NH:6][c:7]2[n:8][c:9]3[n:10]([n:11][c:12]([S:15][c:16]4[c:17]([C:18](=[O:19])[NH:32][c:31]5[cH:30][cH:29][c:28]([C:27]([F:26])([F:35])[F:36])[cH:34][cH:33]5)[cH:21][cH:22][cH:23][cH:24]4)[cH:13][cH:14]3)[cH:25]2)[CH2:2][CH2:3]1

Participants

7

Reactant 6

HCID 6228DimethylformamideHCID 9886HexafluorophosphateHCID 99644-(Trifluoromethyl)anilineHCID 81531DiisopropylethylamineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 57505639HCID 57505639, compound

Product 1

HCID 57505777HCID 57505777, compound

Sources & evidence

ORD record
ord-a13f340535ab40d6ae8fa9538e2c742b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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