Diethyl Ether → dimethyl 3-[4-(7-{[2-(trimethylsilyl)ethoxy]methyl}-7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrazol-1-yl]pentanedioate

HRID 1205442Notes

Reaction equation

HRID 1205442 reaction equation
[C:34]([CH:35]=[CH:36][CH2:37][C:38](=[O:39])[O:40][CH3:41])(=[O:42])[O:43][CH3:44].[CH2:23]1[CH2:24][CH2:25][C:26]2=[N:31][CH2:30][CH2:29][CH2:28][N:27]2[CH2:32][CH2:33]1.[CH2:45]([O:46][CH2:47][CH3:48])[CH3:49].[CH3:50][CH2:51][O:52][C:53](=[O:54])[CH3:55].[nH:1]1[n:2][cH:3][c:4](-[c:6]2[c:7]3[c:8]([n:9][cH:10][n:11]2)[n:12]([CH2:15][O:16][CH2:17][CH2:18][Si:19]([CH3:20])([CH3:21])[CH3:22])[cH:13][cH:14]3)[cH:5]1>>[n:1]1[n:2]([CH:36]([CH2:35][C:34](=[O:42])[O:43][CH3:44])[CH2:37][C:38](=[O:39])[O:40][CH3:41])[cH:3][c:4](-[c:6]2[c:7]3[c:8]([n:9][cH:10][n:11]2)[n:12]([CH2:15][O:16][CH2:17][CH2:18][Si:19]([CH3:20])([CH3:21])[CH3:22])[cH:13][cH:14]3)[cH:5]1

Participants

6

Reactant 5

HCID 3283Diethyl EtherHCID 8857Ethyl AcetateHCID 811841,8-Diazabicyclo(5.4.0)undec-7-eneHCID 2324901,5-Dimethyl 2-pentenedioateHCID 426313464-(1H-Pyrazol-4-yl)-7-(2-(trimethylsilyl)ethoxy)methyl-7 H-pyrrolo(2,3-d)-pyrimidine

Product 1

HCID 57477874dimethyl 3-[4-(7-{[2-(trimethylsilyl)ethoxy]methyl}-7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrazol-1-yl]pentanedioate

Sources & evidence

ORD record
ord-5636c2969f3e4a19bbef94990e24a0bc
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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