Dimethylformamide → 3-[1-(difluoromethoxy)propan-2-yloxy]-N-(1-methylpyrazol-3-yl)-5-phenylmethoxybenzamide

HRID 2152346Notes

Reaction equation

HRID 2152346 reaction equation
[CH3:71][CH2:72][O:73][C:74](=[O:75])[CH3:76].[CH:1]([N:2]([CH2:3][CH3:4])[CH:5]([CH3:6])[CH3:7])([CH3:8])[CH3:9].[F:10][CH:11]([O:12][CH2:13][CH:14]([CH3:15])[O:16][c:17]1[cH:18][c:19]([C:20](=[O:21])[OH:22])[cH:23][c:24]([O:26][CH2:27][c:28]2[cH:29][cH:30][cH:31][cH:32][cH:33]2)[cH:25]1)[F:34].[NH2:35][c:36]1[n:37][n:38]([CH3:41])[cH:39][cH:40]1.[O:66]=[CH:67][N:68]([CH3:69])[CH3:70].[P-:42]([F:43])([F:44])([F:45])([F:46])([F:47])[F:48].[n:49]1([O:50][C:51]([N:52]([CH3:53])[CH3:54])=[N+:55]([CH3:56])[CH3:57])[c:58]2[n:59][cH:60][cH:61][cH:62][c:63]2[n:64][n:65]1>>[F:10][CH:11]([O:12][CH2:13][CH:14]([CH3:15])[O:16][c:17]1[cH:18][c:19]([C:20](=[O:22])[NH:35][c:36]2[n:37][n:38]([CH3:41])[cH:39][cH:40]2)[cH:23][c:24]([O:26][CH2:27][c:28]2[cH:29][cH:30][cH:31][cH:32][cH:33]2)[cH:25]1)[F:34]

Participants

8

Reactant 7

HCID 6228DimethylformamideHCID 8857Ethyl AcetateHCID 9886HexafluorophosphateHCID 81531DiisopropylethylamineHCID 1372541-Methyl-3-aminopyrazoleHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 725241733-[1-(Difluoromethoxy)propan-2-yloxy]-5-phenylmethoxybenzoic acid

Product 1

HCID 674870383-[1-(difluoromethoxy)propan-2-yloxy]-N-(1-methylpyrazol-3-yl)-5-phenylmethoxybenzamide

Sources & evidence

ORD record
ord-e285c44a907f4ea18828c62157f98cfb
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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