Hydrochloric Acid → [4-(5-Ethanesulfonyl-thiazol-2-yl)-piperazin-1-yl]-[5-methanesulfonyl-2-(2,2,2-trifluoro-ethoxy)-phenyl]-methanone

HRID 1539063Notes

Reaction equation

HRID 1539063 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][S:2](=[O:3])(=[O:4])[c:5]1[cH:6][cH:7][c:8]([O:14][CH2:15][C:16]([F:17])([F:18])[F:19])[c:9]([C:10](=[O:11])[OH:12])[cH:13]1.[ClH:20]>>[CH3:1][S:2](=[O:3])(=[O:4])[c:5]1[cH:6][cH:7][c:8]([O:14][CH2:15][C:16]([F:17])([F:18])[F:19])[c:9]([C:10](=[O:12])[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:13]1

Participants

4

Reactant 3

HCID 313Hydrochloric AcidHCID 211001865-Ethylsulfonyl-2-piperazin-1-yl-1,3-thiazoleHCID 211003125-Methanesulfonyl-2-(2,2,2-trifluoro-ethoxy)-benzoic acid

Product 1

HCID 21100275[4-(5-Ethanesulfonyl-thiazol-2-yl)-piperazin-1-yl]-[5-methanesulfonyl-2-(2,2,2-trifluoro-ethoxy)-phenyl]-methanone

Sources & evidence

ORD record
ord-02e51b0c0bc1453c8a4ba47facb84373
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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