Dimethylformamide → HCID 58674630, compound

HRID 698400Notes

Reaction equation

HRID 698400 reaction equation
[CH3:1][NH:2][C:3](=[O:4])[c:5]1[n:6][cH:7][cH:8][c:9]([O:11][c:12]2[cH:13][cH:14][c:15]([CH2:18][CH2:19][C:20](=[O:21])[OH:22])[cH:16][cH:17]2)[cH:10]1.[CH3:72][CH2:73][O:74][C:75]([CH3:76])=[O:77].[CH:58]([N:59]([CH2:60][CH3:61])[CH:62]([CH3:63])[CH3:64])([CH3:65])[CH3:66].[F:23][C:24]([c:25]1[cH:26][c:27]([NH2:28])[cH:29][cH:30][cH:31]1)([F:32])[F:33].[O:67]=[CH:68][N:69]([CH3:70])[CH3:71].[P-:34]([F:35])([F:36])([F:37])([F:38])([F:39])[F:40].[n:41]1([O:42][C:43]([N:44]([CH3:45])[CH3:46])=[N+:47]([CH3:48])[CH3:49])[c:50]2[n:51][cH:52][cH:53][cH:54][c:55]2[n:56][n:57]1>>[CH3:1][NH:2][C:3](=[O:4])[c:5]1[n:6][cH:7][cH:8][c:9]([O:11][c:12]2[cH:13][cH:14][c:15]([CH2:18][CH2:19][C:20](=[O:22])[NH:28][c:27]3[cH:26][c:25]([C:24]([F:23])([F:32])[F:33])[cH:31][cH:30][cH:29]3)[cH:16][cH:17]2)[cH:10]1

Participants

8

Reactant 7

HCID 6228DimethylformamideHCID 73753-(Trifluoromethyl)anilineHCID 8857Ethyl AcetateHCID 9886HexafluorophosphateHCID 81531DiisopropylethylamineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 58674341HCID 58674341, compound

Product 1

HCID 58674630HCID 58674630, compound

Sources & evidence

ORD record
ord-bd047685159b47ce8b35b74035f3d31a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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