Ethanol → N-{3-[2-(2,4-Dichloro-benzoyl)-3-methoxy-benzofuran-6-yl]-benzyl}-methanesulfonamide

HRID 191957Notes

Reaction equation

HRID 191957 reaction equation
[Br:1][c:2]1[cH:3][c:4]2[c:5]([c:6]([O:19][CH3:20])[c:7]([C:9](=[O:10])[c:11]3[c:12]([Cl:18])[cH:13][c:14]([Cl:17])[cH:15][cH:16]3)[o:8]2)[cH:21][cH:22]1.[CH2:50]([OH:51])[CH3:52].[CH3:23][C:24]1([CH3:25])[C:26]([CH3:27])([CH3:28])[O:29][B:30]([c:31]2[cH:32][c:33]([CH2:34][NH:35][S:36](=[O:37])(=[O:38])[CH3:39])[cH:40][cH:41][cH:42]2)[O:43]1.[CH3:60][CH2:61][O:62][C:63]([CH3:64])=[O:65].[Na+:44].[Na+:45].[O-:46][C:47](=[O:48])[O-:49].[c:53]1([CH3:54])[cH:55][cH:56][cH:57][cH:58][cH:59]1>>[c:2]1(-[c:31]2[cH:32][c:33]([CH2:34][NH:35][S:36](=[O:37])(=[O:38])[CH3:39])[cH:40][cH:41][cH:42]2)[cH:3][c:4]2[c:5]([c:6]([O:19][CH3:20])[c:7]([C:9](=[O:10])[c:11]3[c:12]([Cl:18])[cH:13][c:14]([Cl:17])[cH:15][cH:16]3)[o:8]2)[cH:21][cH:22]1

Participants

8

Reactant 7

HCID 702EthanolHCID 923Sodium ion2×HCID 1140TolueneHCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 59298860N-(3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzyl)methanesulfonamideHCID 59788953(6-Bromo-3-methoxybenzofuran2-yl)(2,4-dichloro-phenyl)methanone

Product 1

HCID 59788919N-{3-[2-(2,4-Dichloro-benzoyl)-3-methoxy-benzofuran-6-yl]-benzyl}-methanesulfonamide

Sources & evidence

ORD record
ord-82c819186cc3423db9262944aad08616
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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