Potassium Cation → HCID 178467722, compound

HRID 1120564Notes

Reaction equation

HRID 1120564 reaction equation
[C:50](=[O:51])([O-:52])[O-:53].[CH3:1][O:2][C:3]([CH:4]([CH2:5][c:6]1[c:7]([CH3:13])[cH:8][c:9]([OH:12])[cH:10][cH:11]1)[O:14][CH2:15][CH3:16])=[O:17].[Cl:18][c:19]1[cH:20][c:21](-[c:26]2[s:27][cH:28][c:29]([CH2:31][Cl:32])[n:30]2)[cH:22][cH:23][c:24]1[F:25].[Cl:33][c:34]1[cH:35][c:36]([C:41]([NH2:42])=[S:43])[cH:37][cH:38][c:39]1[F:40].[Cl:44][CH2:45][C:46]([CH2:47][Cl:48])=[O:49].[Cs+:54].[Cs+:55].[I-:57].[K+:56]>>[CH3:1][O:2][C:3]([CH:4]([CH2:5][c:6]1[c:7]([CH3:13])[cH:8][c:9]([O:12][CH2:31][c:29]2[cH:28][s:27][c:26](-[c:21]3[cH:20][c:19]([Cl:18])[c:24]([F:25])[cH:23][cH:22]3)[n:30]2)[cH:10][cH:11]1)[O:14][CH2:15][CH3:16])=[O:17]

Participants

9

Reactant 8

HCID 813Potassium CationHCID 107931,3-DichloroacetoneHCID 19660Carbonate IonHCID 30165Iodide IonHCID 104967Cesium cation2×HCID 27795213-Chloro-4-fluorothiobenzamideHCID 223401432-(3-Chloro-4-fluorophenyl)-4-(chloromethyl)-1,3-thiazoleHCID 69280481Methyl 2-ethoxy-3-(4-hydroxy-2-methylphenyl)propanoate

Product 1

HCID 178467722HCID 178467722, compound

Sources & evidence

ORD record
ord-a41088d89afe40f1aa11f66cdd4d23ec
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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