Potassium Cation → (+/-)-[1-(2,4-Dichloro-pyrimidin-5-yl)-ethyl]-(4-methoxy-phenyl)-amine

Reaction equation

[C:21](=[O:22])([O-:23])[O-:24].[CH3:12][O:13][c:14]1[cH:15][cH:16][c:17]([NH2:20])[cH:18][cH:19]1.[CH3:29][C:30]#[N:31].[Cl:1][c:2]1[n:3][cH:4][c:5]([CH:9]([CH3:10])[Br:11])[c:6]([Cl:8])[n:7]1.[I-:28].[K+:25].[K+:26].[K+:27]>>[Cl:1][c:2]1[n:3][cH:4][c:5]([CH:9]([CH3:10])[NH:20][c:17]2[cH:16][cH:15][c:14]([O:13][CH3:12])[cH:19][cH:18]2)[c:6]([Cl:8])[n:7]1

Participants

Reactant 6

HCID 813Potassium Cation3×

HCID 6342Acetonitrile

HCID 7732P-Anisidine

HCID 19660Carbonate Ion

HCID 30165Iodide Ion

HCID 21908975(+/-)-2,4-Dichloro-5-(1-bromoethyl)-pyrimidine

Product 1

HCID 10086026(+/-)-[1-(2,4-Dichloro-pyrimidin-5-yl)-ethyl]-(4-methoxy-phenyl)-amine

Sources & evidence

ORD record: ord-4a81f0259fba43bda5cecc09dcbdcd6b
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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