Acetate → HCID 54242130, compound

HRID 110549Notes

Reaction equation

HRID 110549 reaction equation
[Br:1][c:2]1[c:3]([NH2:9])[n:4][cH:5][c:6]([Cl:8])[cH:7]1.[C:52]([O-:53])(=[O:54])[CH3:55].[C:57]([O-:58])(=[O:59])[CH3:60].[CH3:17][CH2:18][N:19]([CH2:20][CH3:21])[CH2:22][CH3:23].[CH3:61][OH:62].[CH:10](=[CH2:11])[S:12](=[O:13])(=[O:14])[NH:15][CH3:16].[O:46]=[CH:47][N:48]([CH3:49])[CH3:50].[OH2:51].[Pd+2:56].[c:24]1([CH3:25])[cH:26][cH:27][cH:28][cH:29][c:30]1[P:31]([c:32]1[cH:33][cH:34][cH:35][cH:36][c:37]1[CH3:38])[c:39]1[cH:40][cH:41][cH:42][cH:43][c:44]1[CH3:45]>>[c:2]1([CH:11]=[CH:10][S:12](=[O:13])(=[O:14])[NH:15][CH3:16])[c:3]([NH2:9])[n:4][cH:5][c:6]([Cl:8])[cH:7]1

Participants

10

Reactant 9

HCID 175Acetate2×HCID 887MethanolHCID 962WaterHCID 6228DimethylformamideHCID 8471TriethylamineHCID 80271Tri-o-tolylphosphineHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 27639713-Bromo-5-chloropyridin-2-amineHCID 21895383N-Methylethenesulfonamide

Product 1

HCID 54242130HCID 54242130, compound

Sources & evidence

ORD record
ord-c772f3cdf6b24021b7e0836f21bd0c62
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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