Chloride → [3-({5-Chloro-3-[(4-chloro-3-trifluoromethyl-benzene sulfonyl)-methoxymethyl-amino]-pyridin-2-yl}-hydroxy-methyl)-pyridin-2-yl]-carbamic acid tert-butyl ester

HRID 1207468Notes

Reaction equation

HRID 1207468 reaction equation
[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].[C:32]([CH3:33])([CH3:34])([CH3:35])[O:36][C:37]([NH:38][c:39]1[n:40][cH:41][cH:42][cH:43][c:44]1[CH:45]=[O:46])=[O:47].[CH2:48]1[O:49][CH2:50][CH2:51][CH2:52]1.[CH:28]([Mg+:29])([CH3:30])[CH3:31].[Cl-:27]>>[c:2]1([CH:45]([c:44]2[c:39]([NH:38][C:37]([O:36][C:32]([CH3:33])([CH3:34])[CH3:35])=[O:47])[n:40][cH:41][cH:42][cH:43]2)[OH:46])[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

6

Reactant 5

HCID 312ChlorideHCID 8028TetrahydrofuranHCID 14177125tert-butyl N-(3-formylpyridin-2-yl)carbamateHCID 57942086N-(2-Bromo-5-chloro-pyridin-3-yl)-4-chloro-N-methoxvmethyl-3-trifluoromethyl-benzenesulfonamideHCID 178461726HCID 178461726, compound

Product 1

HCID 57942296[3-({5-Chloro-3-[(4-chloro-3-trifluoromethyl-benzene sulfonyl)-methoxymethyl-amino]-pyridin-2-yl}-hydroxy-methyl)-pyridin-2-yl]-carbamic acid tert-butyl ester

Sources & evidence

ORD record
ord-4bcb8256e59d498faa469ff9f62e22c3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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