Potassium Cation → (4-Methyl-benzyl)-[3-(3-thieno[2,3-d]isoxazol-3-yl-phenoxy)-propyl]-amine

HRID 159169Notes

Reaction equation

HRID 159169 reaction equation
[Br:1][CH2:2][CH2:3][CH2:4][O:5][c:6]1[cH:7][c:8](-[c:12]2[n:13][o:14][c:15]3[c:16]2[s:17][cH:18][cH:19]3)[cH:9][cH:10][cH:11]1.[C:20](=[O:21])([O-:22])[O-:23].[CH3:26][c:27]1[cH:28][cH:29][c:30]([CH2:31][NH2:32])[cH:33][cH:34]1.[CH3:35][C:36]#[N:37].[CH3:38][CH2:39][O:40][C:41](=[O:42])[CH3:43].[Cl:44][CH2:45][Cl:46].[K+:24].[K+:25]>>[CH2:2]([CH2:3][CH2:4][O:5][c:6]1[cH:7][c:8](-[c:12]2[n:13][o:14][c:15]3[c:16]2[s:17][cH:18][cH:19]3)[cH:9][cH:10][cH:11]1)[NH:32][CH2:31][c:30]1[cH:29][cH:28][c:27]([CH3:26])[cH:34][cH:33]1

Participants

8

Reactant 7

HCID 813Potassium Cation2×HCID 6342AcetonitrileHCID 6344DichloromethaneHCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 660354-MethylbenzylamineHCID 219835593-[3-(3-Bromo-propoxy)phenyl]-thieno[2,3-d]isoxazole

Product 1

HCID 21983594(4-Methyl-benzyl)-[3-(3-thieno[2,3-d]isoxazol-3-yl-phenoxy)-propyl]-amine

Sources & evidence

ORD record
ord-deeedbe755be4000b645e0b9f1ccf380
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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