1,2-Dichloroethane → 2-(4-Fluorophenyl)-N-methyl-5-(3-(phenylsulfonylcarbamoyl)phenyl)benzofuran-3-carboxamide

HRID 304288Notes

Reaction equation

HRID 304288 reaction equation
[CH2:30]([Cl:31])[CH2:32][Cl:33].[CH3:49][N:50]([c:51]1[cH:52][cH:53][n:54][cH:55][cH:56]1)[CH3:57].[Cl:45][CH2:46][CH2:47][Cl:48].[ClH:34].[F:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[o:9][c:10]3[c:11]([c:12]2[C:13]([NH:14][CH3:15])=[O:16])[cH:17][c:18](-[c:21]2[cH:22][c:23]([C:24](=[O:25])[OH:26])[cH:27][cH:28][cH:29]2)[cH:19][cH:20]3)[cH:6][cH:7]1.[O:58]=[CH:59][N:60]([CH3:61])[CH3:62].[c:35]1([S:41](=[O:42])(=[O:43])[NH2:44])[cH:36][cH:37][cH:38][cH:39][cH:40]1>>[F:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[o:9][c:10]3[c:11]([c:12]2[C:13]([NH:14][CH3:15])=[O:16])[cH:17][c:18](-[c:21]2[cH:22][c:23]([C:24](=[O:25])[NH:44][S:41]([c:35]4[cH:36][cH:37][cH:38][cH:39][cH:40]4)(=[O:42])=[O:43])[cH:27][cH:28][cH:29]2)[cH:19][cH:20]3)[cH:6][cH:7]1

Participants

7

Reactant 6

HCID 111,2-Dichloroethane2×HCID 313Hydrochloric AcidHCID 6228DimethylformamideHCID 7370BenzenesulfonamideHCID 142844-(Dimethylamino)pyridineHCID 592754243-[2-(4-Fluorophenyl)-3-(methylcarbamoyl)-1-benzofuran-5-yl]benzoic acid

Product 1

HCID 592751942-(4-Fluorophenyl)-N-methyl-5-(3-(phenylsulfonylcarbamoyl)phenyl)benzofuran-3-carboxamide

Sources & evidence

ORD record
ord-2ae81d8a34cc4883a3933e2e9cfed330
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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