Water → N-[2-(3-chlorophenyl)-1-(4-chlorophenyl)but-3-enyl]-2-phenylethenesulfonamide

HRID 673402

Reaction equation

HRID 673402 reaction equation
[CH:20]([N:21]([CH2:22][CH3:23])[CH:24]([CH3:25])[CH3:26])([CH3:27])[CH3:28].[CH:29](=[CH:30][c:31]1[cH:32][cH:33][cH:34][cH:35][cH:36]1)[S:37](=[O:38])(=[O:39])[Cl:40].[Cl:1][c:2]1[cH:3][c:4]([CH:8]([CH:9]([NH2:10])[c:11]2[cH:12][cH:13][c:14]([Cl:17])[cH:15][cH:16]2)[CH:18]=[CH2:19])[cH:5][cH:6][cH:7]1.[Cl:41][CH2:42][Cl:43].[OH2:44]>>[Cl:1][c:2]1[cH:3][c:4]([CH:8]([CH:9]([NH:10][S:37]([CH:29]=[CH:30][c:31]2[cH:32][cH:33][cH:34][cH:35][cH:36]2)(=[O:38])=[O:39])[c:11]2[cH:12][cH:13][c:14]([Cl:17])[cH:15][cH:16]2)[CH:18]=[CH2:19])[cH:5][cH:6][cH:7]1

Participants

6

Reactant 5

HCID 962WaterHCID 6344DichloromethaneHCID 81531DiisopropylethylamineHCID 107500Ethenesulfonyl chloride, 2-phenyl-HCID 768343752-(3-Chlorophenyl)-1-(4-chlorophenyl)but-3-en-1-amine

Product 1

HCID 76834718N-[2-(3-chlorophenyl)-1-(4-chlorophenyl)but-3-enyl]-2-phenylethenesulfonamide

Sources & evidence

ORD record
ord-4f43bc4293e0435da00f83cf3834301d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Linked notes

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