Sodium ion → Ethyl 4,5-dibromo-1-(4-fluorobenzyl)-2-({(2-ethoxy-2-oxoethyl)[(4-methylphenyl)sulfonyl]amino}methyl)-1H-pyrrole-3-carboxylate

HRID 286289Notes

Reaction equation

HRID 286289 reaction equation
[Br:1][c:2]1[c:3]([C:18](=[O:19])[O:20][CH2:21][CH3:22])[c:4]([CH2:16][Br:17])[n:5]([CH2:8][c:9]2[cH:10][cH:11][c:12]([F:15])[cH:13][cH:14]2)[c:6]1[Br:7].[CH2:42]1[O:43][CH2:44][CH2:45][CH2:46]1.[CH3:23][c:24]1[cH:25][cH:26][c:27]([S:30](=[O:31])(=[O:32])[NH:33][CH2:34][C:35](=[O:36])[O:37][CH2:38][CH3:39])[cH:28][cH:29]1.[H-:41].[Na+:40]>>[Br:1][c:2]1[c:3]([C:18](=[O:19])[O:20][CH2:21][CH3:22])[c:4]([CH2:16][N:33]([S:30]([c:27]2[cH:26][cH:25][c:24]([CH3:23])[cH:29][cH:28]2)(=[O:31])=[O:32])[CH2:34][C:35](=[O:36])[O:37][CH2:38][CH3:39])[n:5]([CH2:8][c:9]2[cH:10][cH:11][c:12]([F:15])[cH:13][cH:14]2)[c:6]1[Br:7]

Participants

6

Reactant 5

HCID 923Sodium ionHCID 8028TetrahydrofuranHCID 166653HydrideHCID 230685Ethyl 2-(4-methylphenylsulfonamido)acetateHCID 53237464ethyl 4,5-dibromo-2-(bromomethyl)-1-(4-fluorobenzyl)-1H-pyrrole-3-carboxylate

Product 1

HCID 59855815Ethyl 4,5-dibromo-1-(4-fluorobenzyl)-2-({(2-ethoxy-2-oxoethyl)[(4-methylphenyl)sulfonyl]amino}methyl)-1H-pyrrole-3-carboxylate

Sources & evidence

ORD record
ord-20c15b0a1e6440c08561303650ca8929
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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