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Water → ethyl ({trans-4-[6-{[6-(2-cyanophenyl)pyridin-3-yl]methyl}-5-oxo-7-propyl[1,2,4]triazolo[1,5-a]pyrimidin-4(5H)-yl]cyclohexyl}oxy)acetate

HRID 167388
Notes
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Reaction equation

HRID 167388 reaction equation
[C:1]([Si:2]([CH3:3])([CH3:4])[O:6][CH:7]1[CH2:8][CH2:9][CH:10]([n:13]2[c:14]3[n:15]([c:16]([CH2:35][CH2:36][CH3:37])[c:17]([CH2:20][c:21]4[cH:22][cH:23][c:24](-[c:27]5[c:28]([C:29]#[N:30])[cH:31][cH:32][cH:33][cH:34]5)[n:25][cH:26]4)[c:18]2=[O:19])[n:38][cH:39][n:40]3)[CH2:11][CH2:12]1)([CH3:5])([CH3:41])[CH3:42].[CH3:44][CH2:45][CH2:46][CH2:47][N+:48]([CH2:49][CH2:50][CH2:51][CH3:52])([CH2:53][CH2:54][CH2:55][CH3:56])[CH2:57][CH2:58][CH2:59][CH3:60].[CH3:66][CH2:67][O:68][C:69]([CH3:70])=[O:71].[F-:43].[O:61]1[CH2:62][CH2:63][CH2:64][CH2:65]1.[OH2:72]>>[O:6]([CH:7]1[CH2:8][CH2:9][CH:10]([n:13]2[c:14]3[n:15]([c:16]([CH2:35][CH2:36][CH3:37])[c:17]([CH2:20][c:21]4[cH:22][cH:23][c:24](-[c:27]5[c:28]([C:29]#[N:30])[cH:31][cH:32][cH:33][cH:34]5)[n:25][cH:26]4)[c:18]2=[O:19])[n:38][cH:39][n:40]3)[CH2:11][CH2:12]1)[CH2:70][C:69]([O:68][CH2:67][CH3:66])=[O:71]
ParticipantsSources & evidenceReaction notes

Participants

7

Reactant 6

HCID 962WaterHCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 16028TetrabutylammoniumHCID 28179Fluoride IonHCID 670092682-(5-{[4-(4-{[Tert-butyl(dimethyl)silyl]oxy}cyclohexyl)-5-oxo-7-propyl-4,5-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]methyl}pyridin-2-yl)benzonitrile

Product

1
HCID 86644039ethyl ({trans-4-[6-{[6-(2-cyanophenyl)pyridin-3-yl]methyl}-5-oxo-7-propyl[1,2,4]triazolo[1,5-a]pyrimidin-4(5H)-yl]cyclohexyl}oxy)acetate

Sources & evidence

ORD record
ord-0b745614d4f144eeae17ec8792d71f5f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes