1,2-Dichloroethane → HCID 178500634, compound

HRID 691750Notes

Reaction equation

HRID 691750 reaction equation
[CH2:43]([Cl:44])[CH2:45][Cl:46].[CH3:32][O:33][C:34]([CH:35]([NH2:36])[CH2:37][CH2:38][S:39][CH3:40])=[O:41].[CH3:48][N:49]([c:50]1[cH:51][cH:52][n:53][cH:54][cH:55]1)[CH3:56].[Cl:57][CH2:58][Cl:59].[ClH:42].[ClH:47].[s:1]1[c:2]([CH:6]([CH2:7][n:8]2[cH:9][n:10][cH:11][cH:12]2)[O:13][c:14]2[cH:15][cH:16][c:17]([CH2:23][CH2:24][c:25]3[cH:26][cH:27][c:28]([F:31])[cH:29][cH:30]3)[c:18]([C:19](=[O:20])[OH:21])[cH:22]2)[n:3][cH:4][cH:5]1>>[s:1]1[c:2]([CH:6]([CH2:7][n:8]2[cH:9][n:10][cH:11][cH:12]2)[O:13][c:14]2[cH:15][cH:16][c:17]([CH2:23][CH2:24][c:25]3[cH:26][cH:27][c:28]([F:31])[cH:29][cH:30]3)[c:18]([C:19](=[O:20])[NH:36][CH:35]([C:34]([O:33][CH3:32])=[O:41])[CH2:37][CH2:38][S:39][CH3:40])[cH:22]2)[n:3][cH:4][cH:5]1

Participants

7

Reactant 6

HCID 111,2-DichloroethaneHCID 313Hydrochloric Acid2×HCID 6344DichloromethaneHCID 142844-(Dimethylamino)pyridineHCID 351663Methionine methyl esterHCID 183244285-[1-(Thiazol-2-yl)-2-(imidazol-1-yl)ethoxy]-2-(4-fluorophenethyl)benzoic acid

Product 1

HCID 178500634HCID 178500634, compound

Sources & evidence

ORD record
ord-448588c7164e40a9a68407cd449aa93d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

Loading…