Acetate → 4-tert-butyl-2-chloro-N-[2-(3,4-dichloro-phenyl)-ethyl]-benzamide

HRID 293411Notes

Reaction equation

HRID 293411 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]([Cl:19])[c:8]([O:11][S:12]([C:13]([F:14])([F:15])[F:16])(=[O:17])=[O:18])[cH:9][cH:10]1.[C:65]([O-:66])(=[O:67])[CH3:68].[C:70]([O-:71])(=[O:72])[CH3:73].[Cl:20][c:21]1[cH:22][c:23]([CH2:28][CH2:29][NH2:30])[cH:24][cH:25][c:26]1[Cl:27].[O:60]=[CH:61][N:62]([CH3:63])[CH3:64].[P:31]([CH2:32][CH2:33][CH2:34][P:35]([c:36]1[cH:37][cH:38][cH:39][cH:40][cH:41]1)[c:42]1[cH:43][cH:44][cH:45][cH:46][cH:47]1)([c:48]1[cH:49][cH:50][cH:51][cH:52][cH:53]1)[c:54]1[cH:55][cH:56][cH:57][cH:58][cH:59]1.[Pd+2:69]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]([Cl:19])[c:8]([C:61]([NH:30][CH2:29][CH2:28][c:23]2[cH:22][c:21]([Cl:20])[c:26]([Cl:27])[cH:25][cH:24]2)=[O:60])[cH:9][cH:10]1

Participants

7

Reactant 6

HCID 175Acetate2×HCID 6228DimethylformamideHCID 812191,3-Bis(diphenylphosphino)propaneHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 2179583,4-DichlorophenethylamineHCID 17859607Trifluoro-methanesulfonic acid 4-tert-butyl-2-chloro-phenyl ester

Product 1

HCID 693430314-tert-butyl-2-chloro-N-[2-(3,4-dichloro-phenyl)-ethyl]-benzamide

Sources & evidence

ORD record
ord-20fb15761c994954bd24a948d2e5dbad
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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