Water → 4,4,4-Trifluorobutane-1-sulfonic acid 4-[2-(2,4-dichlorophenyl)-5-methyl-4-(piperidin-1-ylcarbamoyl)imidazol-1-yl]-phenyl ester

HRID 204534Notes

Reaction equation

HRID 204534 reaction equation
[CH3:31][CH2:32][N:33]([CH2:34][CH3:35])[CH2:36][CH3:37].[Cl:50][CH2:51][Cl:52].[F:38][C:39]([CH2:40][CH2:41][CH2:42][S:43](=[O:44])(=[O:45])[Cl:46])([F:47])[F:48].[N:1]1([NH:7][C:8](=[O:9])[c:10]2[n:11][c:12](-[c:23]3[c:24]([Cl:30])[cH:25][c:26]([Cl:29])[cH:27][cH:28]3)[n:13](-[c:16]3[cH:17][cH:18][c:19]([OH:22])[cH:20][cH:21]3)[c:14]2[CH3:15])[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1.[OH2:49]>>[N:1]1([NH:7][C:8](=[O:9])[c:10]2[n:11][c:12](-[c:23]3[c:24]([Cl:30])[cH:25][c:26]([Cl:29])[cH:27][cH:28]3)[n:13](-[c:16]3[cH:17][cH:18][c:19]([O:22][S:43]([CH2:42][CH2:41][CH2:40][C:39]([F:38])([F:47])[F:48])(=[O:44])=[O:45])[cH:20][cH:21]3)[c:14]2[CH3:15])[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1

Participants

6

Reactant 5

HCID 962WaterHCID 6344DichloromethaneHCID 8471TriethylamineHCID 27611764,4,4-trifluorobutane-1-sulfonyl ChlorideHCID 589650752-(2,4-Dichlorophenyl)-1-(4-hydroxyphenyl)-5-methyl-1H-imidazole-4-carboxylic acid piperidin-1-ylamide

Product 1

HCID 116644794,4,4-Trifluorobutane-1-sulfonic acid 4-[2-(2,4-dichlorophenyl)-5-methyl-4-(piperidin-1-ylcarbamoyl)imidazol-1-yl]-phenyl ester

Sources & evidence

ORD record
ord-d3899cb894f84ddbb92dea9cf06aa399
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

Loading…