Hydrochloric Acid → 5-(3,4-Dimethoxyphenyl)-2-{1-[(2,5-dimethoxyphenyl)sulfonyl]piperidin-4-yl}-4,4-dimethyl-2,4-dihydro-3H-pyrazol-3-one

HRID 101385

Reaction equation

HRID 101385 reaction equation
[CH3:26][O:27][c:28]1[c:29]([S:36](=[O:37])(=[O:38])[Cl:39])[cH:30][c:31]([O:34][CH3:35])[cH:32][cH:33]1.[CH3:2][O:3][c:4]1[cH:5][c:6]([C:12]2=[N:16][N:15]([CH:17]3[CH2:18][CH2:19][NH:20][CH2:21][CH2:22]3)[C:14](=[O:23])[C:13]2([CH3:24])[CH3:25])[cH:7][cH:8][c:9]1[O:10][CH3:11].[ClH:1]>>[CH3:2][O:3][c:4]1[cH:5][c:6]([C:12]2=[N:16][N:15]([CH:17]3[CH2:18][CH2:19][N:20]([S:36]([c:29]4[c:28]([O:27][CH3:26])[cH:33][cH:32][c:31]([O:34][CH3:35])[cH:30]4)(=[O:37])=[O:38])[CH2:21][CH2:22]3)[C:14](=[O:23])[C:13]2([CH3:24])[CH3:25])[cH:7][cH:8][c:9]1[O:10][CH3:11]

Participants

4

Reactant 3

HCID 313Hydrochloric AcidHCID 1370252,5-Dimethoxybenzenesulfonyl chlorideHCID 666164075-(3,4-Dimethoxyphenyl)-4,4-dimethyl-2-piperidin-4-yl-2,4-dihydro-3H-pyrazol-3-one

Product 1

HCID 462023965-(3,4-Dimethoxyphenyl)-2-{1-[(2,5-dimethoxyphenyl)sulfonyl]piperidin-4-yl}-4,4-dimethyl-2,4-dihydro-3H-pyrazol-3-one

Sources & evidence

ORD record
ord-faf9d065b2d8439a868fd39fbaae57f0
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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