Ammonium → 4-chloro-N-{5-chloro-2-[(2,4-dimethyl-pyridin-3-yl)-hydroxy-methyl]-pyridin-3-yl}-N-methoxymethyl-3-trifluoromethyl-benzenesulfonamide

HRID 166114Notes

Reaction equation

HRID 166114 reaction equation
[Br-:27].[Br:1][c:2]1[n:3][cH:4][c:5]([Cl:26])[cH:6][c:7]1[N:8]([S:9](=[O:10])(=[O:11])[c:12]1[cH:13][c:14]([C:19]([F:20])([F:21])[F:22])[c:15]([Cl:18])[cH:16][cH:17]1)[CH2:23][O:24][CH3:25].[CH2:42]1[O:43][CH2:44][CH2:45][CH2:46]1.[CH3:32][c:33]1[n:34][cH:35][cH:36][c:37]([CH3:41])[c:38]1[CH:39]=[O:40].[CH:28]([Mg+:29])([CH3:30])[CH3:31].[Cl-:47].[NH4+:48]>>[c:2]1([CH:39]([c:38]2[c:33]([CH3:32])[n:34][cH:35][cH:36][c:37]2[CH3:41])[OH:40])[n:3][cH:4][c:5]([Cl:26])[cH:6][c:7]1[N:8]([S:9](=[O:10])(=[O:11])[c:12]1[cH:13][c:14]([C:19]([F:20])([F:21])[F:22])[c:15]([Cl:18])[cH:16][cH:17]1)[CH2:23][O:24][CH3:25]

Participants

8

Reactant 7

HCID 223AmmoniumHCID 259Bromide ionHCID 312ChlorideHCID 8028TetrahydrofuranHCID 104417552,4-DimethylnicotinaldehydeHCID 57942086N-(2-Bromo-5-chloro-pyridin-3-yl)-4-chloro-N-methoxvmethyl-3-trifluoromethyl-benzenesulfonamideHCID 178461726HCID 178461726, compound

Product 1

HCID 579424994-chloro-N-{5-chloro-2-[(2,4-dimethyl-pyridin-3-yl)-hydroxy-methyl]-pyridin-3-yl}-N-methoxymethyl-3-trifluoromethyl-benzenesulfonamide

Sources & evidence

ORD record
ord-fe2f70c655f34d7da10e62eb48c6e223
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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