Acetonitrile → HCID 17986368, compound

HRID 166218Notes

Reaction equation

HRID 166218 reaction equation
[Br:1][c:2]1[c:3]([Cl:9])[n:4][c:5]([Cl:8])[n:6][cH:7]1.[CH3:10][CH2:11][N:12]([CH2:13][CH3:14])[CH2:15][CH3:16].[CH3:32][C:33]#[N:34].[CH3:35][CH2:36][O:37][C:38](=[O:39])[CH3:40].[N+:17](=[O:18])([O-:19])[c:20]1[cH:21][c:22]([O:23][CH2:24][CH2:25][CH2:26][CH2:27][NH2:28])[cH:29][cH:30][cH:31]1>>[Br:1][c:2]1[c:3]([NH:28][CH2:27][CH2:26][CH2:25][CH2:24][O:23][c:22]2[cH:21][c:20]([N+:17](=[O:18])[O-:19])[cH:31][cH:30][cH:29]2)[n:4][c:5]([Cl:8])[n:6][cH:7]1

Participants

6

Reactant 5

HCID 6342AcetonitrileHCID 8471TriethylamineHCID 8857Ethyl AcetateHCID 2899735-Bromo-2,4-dichloropyrimidineHCID 17986370HCID 17986370, compound

Product 1

HCID 17986368HCID 17986368, compound

Sources & evidence

ORD record
ord-0922d749a1ec458a9198a21fd0dfcaa8
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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