Acetate → [4-Methyl-3-(3-pyrimidin-4-yl-pyridin-2-ylamino)-phenyl]-carbamic acid tert-butyl ester

HRID 1201006Notes

Reaction equation

HRID 1201006 reaction equation
[C:14]([CH3:15])([CH3:16])([CH3:17])[O:18][C:19]([NH:20][c:21]1[cH:22][c:23]([NH2:28])[c:24]([CH3:27])[cH:25][cH:26]1)=[O:29].[CH3:36][c:37]1[cH:38][cH:39][cH:40][cH:41][cH:42]1.[Cl:1][c:2]1[n:3][cH:4][cH:5][cH:6][c:7]1-[c:8]1[n:9][cH:10][n:11][cH:12][cH:13]1.[K+:30].[K+:31].[O-:32][C:33]([O-:34])=[O:35].[O-:44][C:45]([CH3:46])=[O:47].[O-:48][C:49]([CH3:50])=[O:51].[Pd+2:43]>>[c:2]1([NH:28][c:23]2[cH:22][c:21]([NH:20][C:19]([O:18][C:14]([CH3:15])([CH3:16])[CH3:17])=[O:29])[cH:26][cH:25][c:24]2[CH3:27])[n:3][cH:4][cH:5][cH:6][c:7]1-[c:8]1[n:9][cH:10][n:11][cH:12][cH:13]1

Participants

8

Reactant 7

HCID 175Acetate2×HCID 813Potassium Cation2×HCID 1140TolueneHCID 19660Carbonate IonHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 161089744-(2-Chloropyridin-3-yl)pyrimidineHCID 246997865-(Boc-amino)-2-methylaniline

Product 1

HCID 66970434[4-Methyl-3-(3-pyrimidin-4-yl-pyridin-2-ylamino)-phenyl]-carbamic acid tert-butyl ester

Sources & evidence

ORD record
ord-f9e816a588ac49baa7ba7b4c927a2b11
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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