1-(4-(Trifluoromethyl)phenyl)piperazine → (2-Iodo-5-methanesulfonyl-phenyl)-[4-(4-trifluoromethyl-phenyl)-piperazin-1-yl]-methanone

HRID 163098

Reaction equation

HRID 163098 reaction equation
[F:15][C:16]([c:17]1[cH:18][cH:19][c:20]([N:23]2[CH2:24][CH2:25][NH:26][CH2:27][CH2:28]2)[cH:21][cH:22]1)([F:29])[F:30].[I:1][c:2]1[c:3]([C:4](=[O:5])[OH:6])[cH:7][c:8]([S:11](=[O:12])(=[O:13])[CH3:14])[cH:9][cH:10]1>>[I:1][c:2]1[c:3]([C:4](=[O:6])[N:26]2[CH2:25][CH2:24][N:23]([c:20]3[cH:19][cH:18][c:17]([C:16]([F:15])([F:29])[F:30])[cH:22][cH:21]3)[CH2:28][CH2:27]2)[cH:7][c:8]([S:11](=[O:12])(=[O:13])[CH3:14])[cH:9][cH:10]1

Participants

3

Reactant 2

HCID 1217181-(4-(Trifluoromethyl)phenyl)piperazineHCID 574452812-Iodo-5-methanesulfonyl-benzoic acid

Product 1

HCID 59793691(2-Iodo-5-methanesulfonyl-phenyl)-[4-(4-trifluoromethyl-phenyl)-piperazin-1-yl]-methanone

Sources & evidence

ORD record
ord-e9b96779ac1846a482188b5a4c510c5b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Linked notes

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