Dimethylformamide → N-(2-methoxyethyl)-N-methyl-2-(4-{1-[3-(trifluoromethyl)-7,8-dihydro[1,2,4]triazolo[4,3-b]pyridazin-6-yl]piperidin-4-yl}phenoxy)acetamide

HRID 313124Notes

Reaction equation

HRID 313124 reaction equation
[CH3:1][O:2][CH2:3][CH2:4][NH:5][CH3:6].[CH:61]([N:62]([CH2:63][CH3:64])[CH:65]([CH3:66])[CH3:67])([CH3:68])[CH3:69].[F:7][C:8]([c:9]1[n:10][n:11][c:12]2[n:13]1[N:14]=[C:15]([N:18]1[CH2:19][CH2:20][CH:21]([c:24]3[cH:25][cH:26][c:27]([O:28][CH2:29][C:30](=[O:31])[OH:32])[cH:33][cH:34]3)[CH2:22][CH2:23]1)[CH2:16][CH2:17]2)([F:35])[F:36].[O:70]=[CH:71][N:72]([CH3:73])[CH3:74].[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>>[CH3:1][O:2][CH2:3][CH2:4][N:5]([CH3:6])[C:30]([CH2:29][O:28][c:27]1[cH:26][cH:25][c:24]([CH:21]2[CH2:20][CH2:19][N:18]([C:15]3=[N:14][n:13]4[c:9]([C:8]([F:7])([F:35])[F:36])[n:10][n:11][c:12]4[CH2:17][CH2:16]3)[CH2:23][CH2:22]2)[cH:34][cH:33]1)=[O:32]

Participants

7

Reactant 6

HCID 6228DimethylformamideHCID 9886HexafluorophosphateHCID 81531DiisopropylethylamineHCID 300977(2-Methoxyethyl)(methyl)amineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 685023702-[4-[1-[3-(Trifluoromethyl)-7,8-dihydro-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]piperidin-4-yl]phenoxy]acetic acid

Product 1

HCID 46893852N-(2-methoxyethyl)-N-methyl-2-(4-{1-[3-(trifluoromethyl)-7,8-dihydro[1,2,4]triazolo[4,3-b]pyridazin-6-yl]piperidin-4-yl}phenoxy)acetamide

Sources & evidence

ORD record
ord-e5f397c387c84816b17f0b9861833071
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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