Diiodomethane → 4-(Benzoyloxy)-2-(6-chloro-2-iodo-9H-purin-9-yl)-5-[(ethylamino)carbonyl]-tetrahydro-3-furanyl benzoate

HRID 89229

Reaction equation

HRID 89229 reaction equation
[C:8]([c:9]1[cH:10][cH:11][cH:12][cH:13][cH:14]1)(=[O:15])[O:16][CH:17]1[CH:18]([n:36]2[c:37]3[n:38][c:39]([NH2:46])[n:40][c:41]([Cl:45])[c:42]3[n:43][cH:44]2)[O:19][CH:20]([C:31](=[O:32])[NH:33][CH2:34][CH3:35])[CH:21]1[O:22][C:23]([c:24]1[cH:25][cH:26][cH:27][cH:28][cH:29]1)=[O:30].[CH2:51]1[O:52][CH2:53][CH2:54][CH2:55]1.[Cu:56][I:57].[I:47].[I:48][CH2:49][I:50].[N:1]([O:2][CH2:3][CH2:4][CH2:5][CH3:6])=[O:7]>>[C:8]([c:9]1[cH:10][cH:11][cH:12][cH:13][cH:14]1)(=[O:15])[O:16][CH:17]1[CH:18]([n:36]2[c:37]3[n:38][c:39]([I:48])[n:40][c:41]([Cl:45])[c:42]3[n:43][cH:44]2)[O:19][CH:20]([C:31](=[O:32])[NH:33][CH2:34][CH3:35])[CH:21]1[O:22][C:23]([c:24]1[cH:25][cH:26][cH:27][cH:28][cH:29]1)=[O:30]

Participants

7

Reactant 6

HCID 6346DiiodomethaneHCID 8028TetrahydrofuranHCID 10996Butyl nitriteHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 24841Hydrogen iodideHCID 22972463[5-(2-Amino-6-chloropurin-9-yl)-4-benzoyloxy-2-(ethylcarbamoyl)oxolan-3-yl] benzoate

Product 1

HCID 229724694-(Benzoyloxy)-2-(6-chloro-2-iodo-9H-purin-9-yl)-5-[(ethylamino)carbonyl]-tetrahydro-3-furanyl benzoate

Sources & evidence

ORD record
ord-5eebbf89bc52433389c39e71a7d1ed0e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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