Pyridine → 4-[(3-Chloro-4-fluoro-benzenesulfonylamino)-methyl]-4-(4-iodo-phenyl)-piperidine-1-carboxylic acid tert-butyl ester

HRID 135303

Reaction equation

HRID 135303 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][C:11]([c:14]2[cH:15][cH:16][c:17]([I:20])[cH:18][cH:19]2)([CH2:21][NH2:22])[CH2:12][CH2:13]1.[CH3:44][CH2:45][O:46][C:47]([CH3:48])=[O:49].[Cl:23][c:24]1[cH:25][c:26]([S:31](=[O:32])(=[O:33])[Cl:34])[cH:27][cH:28][c:29]1[F:30].[Cl:41][CH2:42][Cl:43].[cH:35]1[cH:36][cH:37][n:38][cH:39][cH:40]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][C:11]([c:14]2[cH:15][cH:16][c:17]([I:20])[cH:18][cH:19]2)([CH2:21][NH:22][S:31]([c:26]2[cH:25][c:24]([Cl:23])[c:29]([F:30])[cH:28][cH:27]2)(=[O:32])=[O:33])[CH2:12][CH2:13]1

Participants

6

Reactant 5

HCID 1049PyridineHCID 6344DichloromethaneHCID 8857Ethyl AcetateHCID 1452223-Chloro-4-fluorobenzenesulphonyl chlorideHCID 207794744-Aminomethyl-4-(4-iodo-phenyl)-piperidine-1-carboxylic acid tert-butyl ester

Product 1

HCID 685333514-[(3-Chloro-4-fluoro-benzenesulfonylamino)-methyl]-4-(4-iodo-phenyl)-piperidine-1-carboxylic acid tert-butyl ester

Sources & evidence

ORD record
ord-145f5cac639641639c4b0b3042a4d8e7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Linked notes

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