Dichloromethane → 6-(3-(2,4-Difluorophenyl)-1-(1-(methylsulfonyl)pyrrolidin-3-yl)-1H-pyrazol-4-yl)-3-isopropyl-[1,2,4]triazolo[4,3-b]pyridazine

HRID 1119892Notes

Reaction equation

HRID 1119892 reaction equation
[CH3:40][S:41]([Cl:42])(=[O:43])=[O:44].[CH:31]([N:32]([CH2:33][CH3:34])[CH:35]([CH3:36])[CH3:37])([CH3:38])[CH3:39].[Cl:45][CH2:46][Cl:47].[F:1][c:2]1[c:3](-[c:9]2[n:10][n:11]([CH:26]3[CH2:27][NH:28][CH2:29][CH2:30]3)[cH:12][c:13]2-[c:14]2[cH:15][cH:16][c:17]3[n:18]([n:19]2)[c:20]([CH:23]([CH3:24])[CH3:25])[n:21][n:22]3)[cH:4][cH:5][c:6]([F:8])[cH:7]1>>[F:1][c:2]1[c:3](-[c:9]2[n:10][n:11]([CH:26]3[CH2:27][N:28]([S:41]([CH3:40])(=[O:43])=[O:44])[CH2:29][CH2:30]3)[cH:12][c:13]2-[c:14]2[cH:15][cH:16][c:17]3[n:18]([n:19]2)[c:20]([CH:23]([CH3:24])[CH3:25])[n:21][n:22]3)[cH:4][cH:5][c:6]([F:8])[cH:7]1

Participants

5

Reactant 4

HCID 6344DichloromethaneHCID 31297Methanesulfonyl chlorideHCID 81531DiisopropylethylamineHCID 579298656-(3-(2,4-Difluorophenyl)-1-(pyrrolidin-3-yl)-1H-pyrazol-4-yl)-3-isopropyl-[1,2,4]triazolo[4,3-b]pyridazine

Product 1

HCID 579298546-(3-(2,4-Difluorophenyl)-1-(1-(methylsulfonyl)pyrrolidin-3-yl)-1H-pyrazol-4-yl)-3-isopropyl-[1,2,4]triazolo[4,3-b]pyridazine

Sources & evidence

ORD record
ord-781a9e1c18dc41708d288a19150d76d5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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