1,2-Dichloroethane → 2-(4-adamantan-1-yl-phenoxy)-N-(3-methanesulfonyl-phenyl)-acetamide

HRID 107939

Reaction equation

HRID 107939 reaction equation
[C:1]12([c:11]3[cH:12][cH:13][c:14]([O:15][CH2:16][C:17](=[O:18])[OH:19])[cH:20][cH:21]3)[CH2:2][CH:3]3[CH2:4][CH:5]([CH2:6][CH:7]([CH2:8]1)[CH2:9]3)[CH2:10]2.[CH2:43]([Cl:44])[CH2:45][Cl:46].[CH3:23][S:24](=[O:25])(=[O:26])[c:27]1[cH:28][c:29]([NH2:33])[cH:30][cH:31][cH:32]1.[CH:34]([N:35]([CH2:36][CH3:37])[CH:38]([CH3:39])[CH3:40])([CH3:41])[CH3:42].[ClH:22].[O:57]=[CH:58][N:59]([CH3:60])[CH3:61].[OH2:62].[OH:47][n:48]1[c:49]2[c:50]([cH:51][cH:52][cH:53][cH:54]2)[n:55][n:56]1>>[C:1]12([c:11]3[cH:12][cH:13][c:14]([O:15][CH2:16][C:17](=[O:18])[NH:33][c:29]4[cH:28][c:27]([S:24]([CH3:23])(=[O:25])=[O:26])[cH:32][cH:31][cH:30]4)[cH:20][cH:21]3)[CH2:2][CH:3]3[CH2:4][CH:5]([CH2:6][CH:7]([CH2:8]1)[CH2:9]3)[CH2:10]2

Participants

9

Reactant 8

HCID 111,2-DichloroethaneHCID 313Hydrochloric AcidHCID 962WaterHCID 6228DimethylformamideHCID 757711-HydroxybenzotriazoleHCID 81531DiisopropylethylamineHCID 4280293-(Methylsulphonyl)anilineHCID 625381PMID26882240-Compound-8

Product 1

HCID 248108932-(4-adamantan-1-yl-phenoxy)-N-(3-methanesulfonyl-phenyl)-acetamide

Sources & evidence

ORD record
ord-46bb733e5fde40efb69a5dd84c77789d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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