Dimethylformamide → HCID 25099656, compound

HRID 690670Notes

Reaction equation

HRID 690670 reaction equation
[CH:62]([N:63]([CH2:64][CH3:65])[CH:66]([CH3:67])[CH3:68])([CH3:69])[CH3:70].[F:1][c:2]1[cH:3][c:4](-[c:8]2[n:9][cH:10][c:11]([C:14](=[O:15])[OH:16])[cH:12][n:13]2)[cH:5][cH:6][cH:7]1.[NH2:51][n:52]1[cH:53][cH:54][c:55]2[c:56]([F:61])[cH:57][cH:58][cH:59][c:60]12.[O:71]=[CH:72][N:73]([CH3:74])[CH3:75].[OH:41][c:42]1[cH:43][cH:44][c:45]2[nH:46][n:47][n:48][c:49]2[n:50]1.[P-:17]([F:18])([F:19])([F:20])([F:21])([F:22])[F:23].[n:24]1([O:25][C:26]([N:27]([CH3:28])[CH3:29])=[N+:30]([CH3:31])[CH3:32])[c:33]2[n:34][cH:35][cH:36][cH:37][c:38]2[n:39][n:40]1>>[F:1][c:2]1[cH:3][c:4](-[c:8]2[n:9][cH:10][c:11]([C:14](=[O:16])[NH:51][n:52]3[cH:53][cH:54][c:55]4[c:56]([F:61])[cH:57][cH:58][cH:59][c:60]34)[cH:12][n:13]2)[cH:5][cH:6][cH:7]1

Participants

8

Reactant 7

HCID 6228DimethylformamideHCID 9886HexafluorophosphateHCID 81531DiisopropylethylamineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 450733632-(3-Fluorophenyl)pyrimidine-5-carboxylic acidHCID 68553171HCID 68553171, compoundHCID 178515788HCID 178515788, compound

Product 1

HCID 25099656HCID 25099656, compound

Sources & evidence

ORD record
ord-3033e90d4545441985d5d0dd3c6781fb
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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