Bromide ion → 2,4-dichloro-N-{4-(cyclopropyl-hydroxy-methyl)-5-[4-(piperidine-1-sulfonyl)-phenylsulfanyl]-pyridin-2-yl}-benzenesulfonamide

HRID 1122334Notes

Reaction equation

HRID 1122334 reaction equation
[Br-:1].[CH2:42]1[O:43][CH2:44][CH2:45][CH2:46]1.[CH:2]1([Mg+:5])[CH2:3][CH2:4]1.[Cl:6][c:7]1[c:8]([S:14](=[O:15])(=[O:16])[NH:17][c:18]2[n:19][cH:20][c:21]([S:26][c:27]3[cH:28][cH:29][c:30]([S:33](=[O:34])(=[O:35])[N:36]4[CH2:37][CH2:38][CH2:39][CH2:40][CH2:41]4)[cH:31][cH:32]3)[c:22]([CH:24]=[O:25])[cH:23]2)[cH:9][cH:10][c:11]([Cl:13])[cH:12]1>>[CH:2]1([CH:24]([c:22]2[c:21]([S:26][c:27]3[cH:28][cH:29][c:30]([S:33](=[O:34])(=[O:35])[N:36]4[CH2:37][CH2:38][CH2:39][CH2:40][CH2:41]4)[cH:31][cH:32]3)[cH:20][n:19][c:18]([NH:17][S:14]([c:8]3[c:7]([Cl:6])[cH:12][c:11]([Cl:13])[cH:10][cH:9]3)(=[O:15])=[O:16])[cH:23]2)[OH:25])[CH2:3][CH2:4]1

Participants

5

Reactant 4

HCID 259Bromide ionHCID 8028TetrahydrofuranHCID 577182462,4-dichloro-N-{4-formyl-5-[4-(piperidine-1-sulfonyl)-phenylsulfanyl]-pyridin-2-yl}-benzenesulfonamideHCID 178507030HCID 178507030, compound

Product 1

HCID 577182332,4-dichloro-N-{4-(cyclopropyl-hydroxy-methyl)-5-[4-(piperidine-1-sulfonyl)-phenylsulfanyl]-pyridin-2-yl}-benzenesulfonamide

Sources & evidence

ORD record
ord-b08724a5cdea4a9d89538d40619d9694
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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