Acetate → 2-[(2,5-dichloropyridin-4-yl)amino]-6-fluoro-N-methylbenzamide

HRID 180139Notes

Reaction equation

HRID 180139 reaction equation
[C:43](=[O:44])([O-:45])[O-:46].[CH3:1][C:2]1([CH3:3])[c:4]2[cH:5][cH:6][cH:7][c:8]([P:9]([c:10]3[cH:11][cH:12][cH:13][cH:14][cH:15]3)[c:16]3[cH:17][cH:18][cH:19][cH:20][cH:21]3)[c:22]2[O:23][c:24]2[c:25]1[cH:26][cH:27][cH:28][c:29]2[P:30]([c:31]1[cH:32][cH:33][cH:34][cH:35][cH:36]1)[c:37]1[cH:38][cH:39][cH:40][cH:41][cH:42]1.[Cl:61][c:62]1[n:63][cH:64][c:65]([Cl:69])[c:66]([I:68])[cH:67]1.[Cs+:47].[Cs+:48].[NH2:49][c:50]1[c:51]([C:52](=[O:53])[NH:54][CH3:55])[c:56]([F:60])[cH:57][cH:58][cH:59]1.[O-:77][C:78]([CH3:79])=[O:80].[O-:81][C:82]([CH3:83])=[O:84].[O:70]1[CH2:71][CH2:72][O:73][CH2:74][CH2:75]1.[Pd+2:76]>>[NH:49]([c:50]1[c:51]([C:52](=[O:53])[NH:54][CH3:55])[c:56]([F:60])[cH:57][cH:58][cH:59]1)[c:66]1[c:65]([Cl:69])[cH:64][n:63][c:62]([Cl:61])[cH:67]1

Participants

9

Reactant 8

HCID 175Acetate2×HCID 19660Carbonate IonHCID 312751,4-DioxaneHCID 104967Cesium cation2×HCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 6360441,1'-(9,9-Dimethyl-9H-xanthene-4,5-diyl)bis(1,1-diphenylphosphine)HCID 208067942-amino-6-fluoro-N-methylbenzamideHCID 534009652,5-Dichloro-4-iodopyridine

Product 1

HCID 866551412-[(2,5-dichloropyridin-4-yl)amino]-6-fluoro-N-methylbenzamide

Sources & evidence

ORD record
ord-29c44a4e949a4a498d179ac95f98ae8f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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