Acetate → 4-[1-(2-cyano-1-cyclopentylethyl)-1H-pyrazol-4-yl]-2-methoxy-7H-pyrrolo[2,3-d]pyrimidin-5-yl acetate

HRID 317751Notes

Reaction equation

HRID 317751 reaction equation
[Ag+:35].[C:31]([O-:32])(=[O:33])[CH3:34].[CH3:27][C:28]([OH:29])=[O:30].[CH:1]1([CH:6]([CH2:7][C:8]#[N:9])[n:10]2[n:11][cH:12][c:13](-[c:15]3[c:16]4[c:17]([n:18][c:19]([O:21][CH3:22])[n:20]3)[nH:23][cH:24][c:25]4[I:26])[cH:14]2)[CH2:2][CH2:3][CH2:4][CH2:5]1>>[CH:1]1([CH:6]([CH2:7][C:8]#[N:9])[n:10]2[n:11][cH:12][c:13](-[c:15]3[c:16]4[c:17]([n:18][c:19]([O:21][CH3:22])[n:20]3)[nH:23][cH:24][c:25]4[O:30][C:28]([CH3:27])=[O:29])[cH:14]2)[CH2:2][CH2:3][CH2:4][CH2:5]1

Participants

5

Reactant 4

HCID 175AcetateHCID 176Acetic AcidHCID 104755Silver cationHCID 670948833-cyclopentyl-3-[4-(5-iodo-2-methoxy-7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrazol-1-yl]propanenitrile

Product 1

HCID 670946744-[1-(2-cyano-1-cyclopentylethyl)-1H-pyrazol-4-yl]-2-methoxy-7H-pyrrolo[2,3-d]pyrimidin-5-yl acetate

Sources & evidence

ORD record
ord-e3a986d9077e4c4b8986e168e77e2abf
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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