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Acetonitrile → 6-[(4-aminophenyl)ethynyl]-N4-{3-methyl-4-[(6-methylpyridin-3-yl)oxy]phenyl}pyrimidine-4,5-diamine

HRID 808809
Notes
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Reaction equation

HRID 808809 reaction equation
[C:26](#[CH:27])[c:28]1[cH:29][cH:30][c:31]([NH2:32])[cH:33][cH:34]1.[CH3:35][C:36]#[N:37].[Cu:38][I:39].[I:2][c:3]1[c:4]([NH2:25])[c:5]([NH:9][c:10]2[cH:11][c:12]([CH3:24])[c:13]([O:16][c:17]3[cH:18][n:19][c:20]([CH3:23])[cH:21][cH:22]3)[cH:14][cH:15]2)[n:6][cH:7][n:8]1.[IH:1]>>[c:3]1([C:27]#[C:26][c:28]2[cH:29][cH:30][c:31]([NH2:32])[cH:33][cH:34]2)[c:4]([NH2:25])[c:5]([NH:9][c:10]2[cH:11][c:12]([CH3:24])[c:13]([O:16][c:17]3[cH:18][n:19][c:20]([CH3:23])[cH:21][cH:22]3)[cH:14][cH:15]2)[n:6][cH:7][n:8]1
ParticipantsSources & evidenceReaction notes

Participants

6

Reactant 5

HCID 6342AcetonitrileHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 24841Hydrogen iodideHCID 37600254-EthynylanilineHCID 866157486-iodo-4-N-[3-methyl-4-[(6-methyl-3-pyridinyl)oxy]phenyl]pyrimidine-4,5-diamine

Product 1

HCID 67521091
6-[(4-aminophenyl)ethynyl]-N4-{3-methyl-4-[(6-methylpyridin-3-yl)oxy]phenyl}pyrimidine-4,5-diamine

Sources & evidence

ORD record
ord-fd148d1eeaea4016ac86cb1cf00d6364
Source dataset
Test data from https://doi.org/10.1039/C8SC04228D
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes