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

HRID 190339Notes

Reaction equation

HRID 190339 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.[CH:1]1([O:6][c:7]2[c:8]([C:9](=[O:10])[OH:11])[cH:12][c:13]([S:16](=[O:17])(=[O:18])[CH3:19])[cH:14][cH:15]2)[CH2:2][CH2:3][CH2:4][CH2:5]1.[ClH:20]>>[CH:1]1([O:6][c:7]2[c:8]([C:9](=[O:11])[N:34]3[CH2:33][CH2:32][N:31]([c:29]4[n:28][cH:27][c:26]([S:23]([CH2:21][CH3:22])(=[O:24])=[O:25])[s:30]4)[CH2:36][CH2:35]3)[cH:12][c:13]([S:16](=[O:17])(=[O:18])[CH3:19])[cH:14][cH:15]2)[CH2:2][CH2:3][CH2:4][CH2:5]1

Participants

4

Reactant 3

HCID 313Hydrochloric AcidHCID 211001865-Ethylsulfonyl-2-piperazin-1-yl-1,3-thiazoleHCID 211002232-Cyclopentyloxy-5-methanesulfonyl-benzoic acid

Product 1

HCID 21100225(2-Cyclopentyloxy-5-methanesulfonyl-phenyl)-[4-(5-ethanesulfonyl-thiazol-2-yl)-piperazin-1-yl]-methanone

Sources & evidence

ORD record
ord-d6bfc0aa818a464e876e32383176f056
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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