Hydrochloric Acid → [2-(2,2-Dimethyl-propoxy)-5-methanesulfonyl-phenyl]-[4-(5-ethanesulfonyl-thiazol-2-yl)-piperazin-1-yl]-methanone

HRID 2329467Notes

Reaction equation

HRID 2329467 reaction equation
[CH2:21]([CH3:22])[S:23](=[O:24])(=[O:25])[c:26]1[cH:27][n:28][c:29]([N:31]2[CH2:32][CH2:33][NH:34][CH2:35][CH2:36]2)[s:30]1.[CH3:1][C:2]([CH2:3][O:4][c:5]1[c:6]([C:7](=[O:8])[OH:9])[cH:10][c:11]([S:14](=[O:15])(=[O:16])[CH3:17])[cH:12][cH:13]1)([CH3:18])[CH3:19].[ClH:20]>>[CH3:1][C:2]([CH2:3][O:4][c:5]1[c:6]([C:7](=[O:9])[N:34]2[CH2:33][CH2:32][N:31]([c:29]3[n:28][cH:27][c:26]([S:23]([CH2:21][CH3:22])(=[O:24])=[O:25])[s:30]3)[CH2:36][CH2:35]2)[cH:10][c:11]([S:14](=[O:15])(=[O:16])[CH3:17])[cH:12][cH:13]1)([CH3:18])[CH3:19]

Participants

4

Reactant 3

HCID 313Hydrochloric AcidHCID 211001865-Ethylsulfonyl-2-piperazin-1-yl-1,3-thiazoleHCID 211002032-(2,2-Dimethyl-propoxy)-5-methanesulfonyl-benzoic acid

Product 1

HCID 21100204[2-(2,2-Dimethyl-propoxy)-5-methanesulfonyl-phenyl]-[4-(5-ethanesulfonyl-thiazol-2-yl)-piperazin-1-yl]-methanone

Sources & evidence

ORD record
ord-5ad12f9195ca4c24a7e162ba920c7924
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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