Dichloromethane → (4-(2-Thiophenylsulfonyl)-1-(4-(2,2,2-trifluoro-1-hydroxy-1-methylethyl)phenyl)-2-piperazinyl)methyl methanesulfonate

HRID 690755Notes

Reaction equation

HRID 690755 reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][CH2:9][CH:10]1[N:11]([c:24]2[cH:25][cH:26][c:27]([C:30]([C:31]([F:32])([F:33])[F:34])([CH3:35])[OH:36])[cH:28][cH:29]2)[CH2:12][CH2:13][N:14]([S:16](=[O:17])(=[O:18])[c:19]2[s:20][cH:21][cH:22][cH:23]2)[CH2:15]1.[CH3:37][CH2:38][N:39]([CH2:40][CH3:41])[CH2:42][CH3:43].[CH3:44][S:45]([Cl:46])(=[O:47])=[O:48].[Cl:49][CH2:50][Cl:51]>>[O:8]([CH2:9][CH:10]1[N:11]([c:24]2[cH:25][cH:26][c:27]([C:30]([C:31]([F:32])([F:33])[F:34])([CH3:35])[OH:36])[cH:28][cH:29]2)[CH2:12][CH2:13][N:14]([S:16](=[O:17])(=[O:18])[c:19]2[s:20][cH:21][cH:22][cH:23]2)[CH2:15]1)[S:45]([CH3:44])(=[O:47])=[O:48]

Participants

5

Reactant 4

HCID 6344DichloromethaneHCID 8471TriethylamineHCID 31297Methanesulfonyl chlorideHCID 665825752-(4-(2-((Benzyloxy)methyl)-4-(2-thiophenylsulfonyl)-1-piperazinyl)phenyl)-1,1,1-trifluoro-2-propanol

Product 1

HCID 86670324(4-(2-Thiophenylsulfonyl)-1-(4-(2,2,2-trifluoro-1-hydroxy-1-methylethyl)phenyl)-2-piperazinyl)methyl methanesulfonate

Sources & evidence

ORD record
ord-a18d2d51bbf441c78a2c58fb0729d3f5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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