Water → [5-Methanesulfonyl-2-(4-methyl-thiazol-2-yl)-phenyl]-[4-(4-trifluoromethyl-phenyl)-piperazin-1-yl]-methanone

HRID 1236510Notes

Reaction equation

HRID 1236510 reaction equation
[CH3:1][S:2](=[O:3])(=[O:4])[c:5]1[cH:6][cH:7][c:8]([Sn:29]([CH3:30])([CH3:31])[CH3:32])[c:9]([C:11](=[O:12])[N:13]2[CH2:14][CH2:15][N:16]([c:19]3[cH:20][cH:21][c:22]([C:25]([F:26])([F:27])[F:28])[cH:23][cH:24]3)[CH2:17][CH2:18]2)[cH:10]1.[CH3:59][N:60]([CH3:61])[CH:62]=[O:63].[Cu:65]([I:66])[I:67].[I:33][c:34]1[s:35][cH:36][c:37]([CH3:39])[n:38]1.[OH2:64].[cH:40]1[cH:41][cH:42][c:43]([As:44]([c:45]2[cH:46][cH:47][cH:48][cH:49][cH:50]2)[c:51]2[cH:52][cH:53][cH:54][cH:55][cH:56]2)[cH:57][cH:58]1>>[CH3:1][S:2](=[O:3])(=[O:4])[c:5]1[cH:6][cH:7][c:8](-[c:34]2[s:35][cH:36][c:37]([CH3:39])[n:38]2)[c:9]([C:11](=[O:12])[N:13]2[CH2:14][CH2:15][N:16]([c:19]3[cH:20][cH:21][c:22]([C:25]([F:26])([F:27])[F:28])[cH:23][cH:24]3)[CH2:17][CH2:18]2)[cH:10]1

Participants

7

Reactant 6

HCID 962WaterHCID 6228DimethylformamideHCID 11773TriphenylarsineHCID 83717Copper iodideHCID 231545942-Iodo-4-methyl-1,3-thiazoleHCID 59853642(5-Methanesulfonyl-2-trimethylstannanyl-phenyl)-[4-(4-trifluoromethyl-phenyl)-piperazin-1-yl]-methanone

Product 1

HCID 59853697[5-Methanesulfonyl-2-(4-methyl-thiazol-2-yl)-phenyl]-[4-(4-trifluoromethyl-phenyl)-piperazin-1-yl]-methanone

Sources & evidence

ORD record
ord-8b62940ae5d3458a937f609fba718a98
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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