Sodium ion → p-Hexadecylamino-N-(methylsulfonyl)benzamide

HRID 2157243

Reaction equation

HRID 2157243 reaction equation
[CH2:38]([CH2:39][O:40][CH3:41])[O:42][CH3:43].[CH2:44]([Cl:45])[Cl:46].[CH2:8]([CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH3:23])[NH:24][c:25]1[cH:26][cH:27][c:28]([C:29](=[O:30])[OH:31])[cH:32][cH:33]1.[CH3:1][S:2](=[O:3])(=[O:4])[NH2:5].[CH3:47][C:48]([N:49]([CH3:50])[CH3:51])=[O:52].[H-:6].[Na+:7].[OH2:53].[S:34]([Cl:35])([Cl:36])=[O:37]>>[CH3:1][S:2](=[O:3])(=[O:4])[NH:5][C:29]([c:28]1[cH:27][cH:26][c:25]([NH:24][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH3:23])[cH:33][cH:32]1)=[O:30]

Participants

10

Reactant 9

HCID 923Sodium ionHCID 962WaterHCID 6344DichloromethaneHCID 80711,2-DimethoxyethaneHCID 24386Thionyl ChlorideHCID 31374DimethylacetamideHCID 472634-(Hexadecylamino)benzoic acidHCID 72879MethanesulfonamideHCID 166653Hydride

Product 1

HCID 20437358p-Hexadecylamino-N-(methylsulfonyl)benzamide

Sources & evidence

ORD record
ord-34447f54ee5b4b77b499f09763ba882f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Linked notes

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