Methanol → ethyl 4,5-dibromo-1-(4-fluorobenzyl)-2-({(2-methoxy-2-oxoethyl)[(4-methylphenyl)sulfonyl]amino}methyl)-1H-pyrrole-3-carboxylate

HRID 126386Notes

Reaction equation

HRID 126386 reaction equation
[Br:19][c:20]1[c:21]([C:36](=[O:37])[O:38][CH2:39][CH3:40])[c:22]([CH2:34][Br:35])[n:23]([CH2:26][c:27]2[cH:28][cH:29][c:30]([F:33])[cH:31][cH:32]2)[c:24]1[Br:25].[CH3:1][c:2]1[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[NH:11][CH2:12][C:13](=[O:14])[O:15][CH3:16])[cH:6][cH:7]1.[CH3:41][OH:42].[Cl:48][CH2:49][Cl:50].[H-:18].[Na+:17].[O:43]=[CH:44][N:45]([CH3:46])[CH3:47]>>[CH3:1][c:2]1[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[N:11]([CH2:12][C:13](=[O:14])[O:15][CH3:16])[CH2:34][c:22]2[c:21]([C:36](=[O:37])[O:38][CH2:39][CH3:40])[c:20]([Br:19])[c:24]([Br:25])[n:23]2[CH2:26][c:27]2[cH:28][cH:29][c:30]([F:33])[cH:31][cH:32]2)[cH:6][cH:7]1

Participants

8

Reactant 7

HCID 887MethanolHCID 923Sodium ionHCID 6228DimethylformamideHCID 6344DichloromethaneHCID 166653HydrideHCID 562880Methyl 2-(4-methylphenylsulfonamido)acetateHCID 53237464ethyl 4,5-dibromo-2-(bromomethyl)-1-(4-fluorobenzyl)-1H-pyrrole-3-carboxylate

Product 1

HCID 53237465ethyl 4,5-dibromo-1-(4-fluorobenzyl)-2-({(2-methoxy-2-oxoethyl)[(4-methylphenyl)sulfonyl]amino}methyl)-1H-pyrrole-3-carboxylate

Sources & evidence

ORD record
ord-0e7c8204a75b40b68f0777554f1c0203
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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