Acetate → 3-(4-Chloro-2-morpholinothiazol-5-yl)-2,6-dimethyl-8-(pentan-3-yl)imidazo[1,2-b]pyridazine

HRID 1540858Notes

Reaction equation

HRID 1540858 reaction equation
[C:49](=[O:50])([O-:51])[O-:52].[CH2:1]([CH3:2])[CH:3]([CH2:4][CH3:5])[c:6]1[c:7]2[n:8]([n:9][c:10]([CH3:12])[cH:11]1)[c:13]([I:17])[c:14]([CH3:16])[n:15]2.[Cs+:53].[Cs+:54].[Cu:64]([I:65])[I:66].[O-:56][C:57]([CH3:58])=[O:59].[O-:60][C:61]([CH3:62])=[O:63].[O:18]1[CH2:19][CH2:20][N:21]([c:24]2[s:25][cH:26][c:27]([Cl:29])[n:28]2)[CH2:22][CH2:23]1.[Pd+2:55].[c:30]1([P:31]([c:32]2[cH:33][cH:34][cH:35][cH:36][cH:37]2)[c:38]2[cH:39][cH:40][cH:41][cH:42][cH:43]2)[cH:44][cH:45][cH:46][cH:47][cH:48]1>>[CH2:1]([CH3:2])[CH:3]([CH2:4][CH3:5])[c:6]1[c:7]2[n:8]([n:9][c:10]([CH3:12])[cH:11]1)[c:13](-[c:26]1[s:25][c:24]([N:21]3[CH2:20][CH2:19][O:18][CH2:23][CH2:22]3)[n:28][c:27]1[Cl:29])[c:14]([CH3:16])[n:15]2

Participants

9

Reactant 8

HCID 175Acetate2×HCID 11776TriphenylphosphineHCID 19660Carbonate IonHCID 83717Copper iodideHCID 104967Cesium cation2×HCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 534400954-(4-Chlorothiazol-2-YL)morpholineHCID 577526818-(1-Ethyl-propyl)-3-iodo-2,6-dimethyl-imidazo[1,2-b]pyridazine

Product 1

HCID 115462553-(4-Chloro-2-morpholinothiazol-5-yl)-2,6-dimethyl-8-(pentan-3-yl)imidazo[1,2-b]pyridazine

Sources & evidence

ORD record
ord-d8063db07483496ab761e7515cfdc889
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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