Potassium Cation → tert-Butyl {3-[5-(4-aminothieno[2,3-d]pyrimidin-6-yl)-1-methyl-1H-imidazol-4-yl]phenyl}carbamate

HRID 2332119Notes

Reaction equation

HRID 2332119 reaction equation
[C:24]([NH2:25])([O:26][C:27]([CH3:28])([CH3:29])[CH3:30])=[O:31].[CH2:46]1[O:47][CH2:48][CH2:49][O:50][CH2:51]1.[CH3:32][NH:33][CH2:34][CH2:35][NH:36][CH3:37].[Cu:52][I:53].[I:1][c:2]1[cH:3][c:4](-[c:8]2[n:9][cH:10][n:11]([CH3:23])[c:12]2-[c:13]2[cH:14][c:15]3[c:16]([n:17][cH:18][n:19][c:20]3[NH2:21])[s:22]2)[cH:5][cH:6][cH:7]1.[K+:43].[K+:44].[K+:45].[P:38]([O-:39])([O-:40])([O-:41])=[O:42]>>[c:2]1([NH:25][C:24]([O:26][C:27]([CH3:28])([CH3:29])[CH3:30])=[O:31])[cH:3][c:4](-[c:8]2[n:9][cH:10][n:11]([CH3:23])[c:12]2-[c:13]2[cH:14][c:15]3[c:16]([n:17][cH:18][n:19][c:20]3[NH2:21])[s:22]2)[cH:5][cH:6][cH:7]1

Participants

8

Reactant 7

HCID 813Potassium Cation3×HCID 1061PhosphateHCID 8070N,N'-DimethylethylenediamineHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 312751,4-DioxaneHCID 77922tert-Butyl carbamateHCID 103206356-(4-(3-iodophenyl)-1-methyl-1H-imidazol-5-yl)thieno[2,3-d]pyrimidin-4-amine

Product 1

HCID 86760727tert-Butyl {3-[5-(4-aminothieno[2,3-d]pyrimidin-6-yl)-1-methyl-1H-imidazol-4-yl]phenyl}carbamate

Sources & evidence

ORD record
ord-30322646f84b4696bf6c986a24182741
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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