Acetate → 4-(6-Methoxy-4-thiazol-2-yl-phthalazin-1-yl)-butyric acid methyl ester

HRID 318052Notes

Reaction equation

HRID 318052 reaction equation
[Br:21][c:22]1[s:23][cH:24][cH:25][n:26]1.[C:47]([O-:48])(=[O:49])[CH3:50].[C:52]([O-:53])(=[O:54])[CH3:55].[CH3:1][O:2][C:3]([CH2:4][CH2:5][CH2:6][c:7]1[n:8][n:9][c:10]([Cl:19])[c:11]2[cH:12][c:13]([O:17][CH3:18])[cH:14][cH:15][c:16]12)=[O:20].[Pd+2:51].[Zn:46].[c:27]1([P:28]([c:29]2[cH:30][cH:31][cH:32][cH:33][cH:34]2)[c:35]2[cH:36][cH:37][cH:38][cH:39][cH:40]2)[cH:41][cH:42][cH:43][cH:44][cH:45]1>>[CH3:1][O:2][C:3]([CH2:4][CH2:5][CH2:6][c:7]1[n:8][n:9][c:10](-[c:22]2[s:23][cH:24][cH:25][n:26]2)[c:11]2[cH:12][c:13]([O:17][CH3:18])[cH:14][cH:15][c:16]12)=[O:20]

Participants

7

Reactant 6

HCID 175Acetate2×HCID 11776TriphenylphosphineHCID 23994ZincHCID 764302-BromothiazoleHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 542691004-(4-Chloro-6-methoxy-phthalazin-1-yl)-butyric acid methyl ester

Product 1

HCID 543700044-(6-Methoxy-4-thiazol-2-yl-phthalazin-1-yl)-butyric acid methyl ester

Sources & evidence

ORD record
ord-deb0384a894749a49fd16683c13d1f19
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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