Dimethylformamide → 3-(1-methoxybutan-2-yloxy)-N-(1-methylpyrazol-3-yl)-5-phenylmethoxybenzamide

HRID 2332064Notes

Reaction equation

HRID 2332064 reaction equation
[CH3:1][O:2][CH2:3][CH:4]([CH2:5][CH3:6])[O:7][c:8]1[cH:9][c:10]([C:11](=[O:12])[OH:13])[cH:14][c:15]([O:17][CH2:18][c:19]2[cH:20][cH:21][cH:22][cH:23][cH:24]2)[cH:16]1.[CH:56]([N:57]([CH2:58][CH3:59])[CH:60]([CH3:61])[CH3:62])([CH3:63])[CH3:64].[NH2:25][c:26]1[n:27][n:28]([CH3:31])[cH:29][cH:30]1.[O:65]=[CH:66][N:67]([CH3:68])[CH3:69].[P-:32]([F:33])([F:34])([F:35])([F:36])([F:37])[F:38].[n:39]1([O:40][C:41]([N:42]([CH3:43])[CH3:44])=[N+:45]([CH3:46])[CH3:47])[c:48]2[n:49][cH:50][cH:51][cH:52][c:53]2[n:54][n:55]1>>[CH3:1][O:2][CH2:3][CH:4]([CH2:5][CH3:6])[O:7][c:8]1[cH:9][c:10]([C:11](=[O:13])[NH:25][c:26]2[n:27][n:28]([CH3:31])[cH:29][cH:30]2)[cH:14][c:15]([O:17][CH2:18][c:19]2[cH:20][cH:21][cH:22][cH:23][cH:24]2)[cH:16]1

Participants

7

Reactant 6

HCID 6228DimethylformamideHCID 9886HexafluorophosphateHCID 81531DiisopropylethylamineHCID 1372541-Methyl-3-aminopyrazoleHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 725241503-(1-Methoxybutan-2-yloxy)-5-phenylmethoxybenzoic acid

Product 1

HCID 671091803-(1-methoxybutan-2-yloxy)-N-(1-methylpyrazol-3-yl)-5-phenylmethoxybenzamide

Sources & evidence

ORD record
ord-d759233a56d64b029f82e70e78799a50
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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