Hydrochloric Acid → HCID 11592017, compound

HRID 138751Notes

Reaction equation

HRID 138751 reaction equation
[CH3:1][S:2](=[O:3])(=[O:4])[c:5]1[cH:6][cH:7][c:8]([O:14][CH:15]([C:16]([F:17])([F:18])[F:19])[CH3:20])[c:9]([C:10](=[O:11])[OH:12])[cH:13]1.[ClH:21].[F:22][C:23]([CH2:24][c:25]1[cH:26][n:27][c:28]([N:30]2[CH2:31][CH2:32][NH:33][CH2:34][CH2:35]2)[s:29]1)([F:36])[F:37]>>[CH3:1][S:2](=[O:3])(=[O:4])[c:5]1[cH:6][cH:7][c:8]([O:14][CH:15]([C:16]([F:17])([F:18])[F:19])[CH3:20])[c:9]([C:10](=[O:12])[N:33]2[CH2:32][CH2:31][N:30]([c:28]3[n:27][cH:26][c:25]([CH2:24][C:23]([F:22])([F:36])[F:37])[s:29]3)[CH2:35][CH2:34]2)[cH:13]1

Participants

4

Reactant 3

HCID 313Hydrochloric AcidHCID 211001802-Piperazin-1-yl-5-(2,2,2-trifluoroethyl)-1,3-thiazoleHCID 211003065-Methylsulfonyl-2-(2,2,2-trifluoro-1-methylethoxy)benzoic acid

Product 1

HCID 11592017HCID 11592017, compound

Sources & evidence

ORD record
ord-65d9b0a7fd8c4d67b1f5971cdbefc5e7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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