Sodium ion → N,N-diethylaminocarbonylmethyl 3-aminosulfonyl-5-butylamino-4-phenoxybenzoate

HRID 153242

Reaction equation

HRID 153242 reaction equation
[CH3:1][CH2:2][CH2:3][CH2:4][NH:5][c:6]1[cH:7][c:8]([C:23]([OH:24])=[O:25])[cH:9][c:10]([S:19]([NH2:20])(=[O:21])=[O:22])[c:11]1[O:12][c:13]1[cH:14][cH:15][cH:16][cH:17][cH:18]1.[CH3:35][CH2:36][N:37]([CH2:38][CH3:39])[CH2:40][CH3:41].[CH3:44][N:45]([CH3:46])[CH:47]=[O:48].[Cl:26][CH2:27][C:28](=[O:29])[N:30]([CH2:31][CH3:32])[CH2:33][CH3:34].[Cl:49][CH2:50][Cl:51].[I-:43].[Na+:42]>>[CH3:1][CH2:2][CH2:3][CH2:4][NH:5][c:6]1[cH:7][c:8]([C:23]([O:24][CH2:27][C:28](=[O:29])[N:30]([CH2:31][CH3:32])[CH2:33][CH3:34])=[O:25])[cH:9][c:10]([S:19]([NH2:20])(=[O:21])=[O:22])[c:11]1[O:12][c:13]1[cH:14][cH:15][cH:16][cH:17][cH:18]1

Participants

8

Reactant 7

HCID 923Sodium ionHCID 2471BumetanideHCID 6228DimethylformamideHCID 6344DichloromethaneHCID 8471TriethylamineHCID 16844Chloro-N,N-diethylacetamideHCID 30165Iodide Ion

Product 1

HCID 16657241N,N-diethylaminocarbonylmethyl 3-aminosulfonyl-5-butylamino-4-phenoxybenzoate

Sources & evidence

ORD record
ord-91e0e1faa9f24fd087367c80db5918e8
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Linked notes

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