Methane → 4-({[3-(2-Chloro-pyrimidin-4-yl)-benzyl]-methanesulfonyl-amino}-methyl)-piperidine-1-carboxylic acid tert-butyl ester

HRID 2149984Notes

Reaction equation

HRID 2149984 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][CH:11]([CH2:14][NH:15][CH2:16][c:17]2[cH:18][c:19](-[c:23]3[n:24][c:25]([Cl:29])[n:26][cH:27][cH:28]3)[cH:20][cH:21][cH:22]2)[CH2:12][CH2:13]1.[CH4:35].[S:30](=[O:31])(=[O:32])([Cl:33])[Cl:34]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][CH:11]([CH2:14][N:15]([CH2:16][c:17]2[cH:18][c:19](-[c:23]3[n:24][c:25]([Cl:29])[n:26][cH:27][cH:28]3)[cH:20][cH:21][cH:22]2)[S:30](=[O:31])(=[O:32])[CH3:35])[CH2:12][CH2:13]1

Participants

4

Reactant 3

HCID 297MethaneHCID 24648Sulfuryl chlorideHCID 866032664-{[3-(2-Chloro-pyrimidin-4-yl)-benzylamino]-methyl}-piperidine-1-carboxylic acid tert-butyl ester

Product 1

HCID 866032674-({[3-(2-Chloro-pyrimidin-4-yl)-benzyl]-methanesulfonyl-amino}-methyl)-piperidine-1-carboxylic acid tert-butyl ester

Sources & evidence

ORD record
ord-ffa9179174b3404194b3fa591246d363
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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