Water → 4'-{[1-(4-{[trans-4-(1-{[Tert-butyl(dimethyl)silyl]oxy}-1-methylethyl)cyclohexyl]oxy}phenyl)-2-ethyl-6-oxo-4-propyl-1,6-dihydropyrimidin-5-yl]methyl}biphenyl-2-carbonitrile

HRID 316268Notes

Reaction equation

HRID 316268 reaction equation
[C:35]([CH3:36])([CH3:37])([CH3:38])[Si:39]([O:40][C:41]([CH3:42])([CH3:43])[CH:44]1[CH2:45][CH2:46][CH:47]([OH:50])[CH2:48][CH2:49]1)([CH3:51])[CH3:52].[CH2:1]([CH3:2])[c:3]1[n:4](-[c:28]2[cH:29][cH:30][c:31]([OH:34])[cH:32][cH:33]2)[c:5](=[O:27])[c:6]([CH2:12][c:13]2[cH:14][cH:15][c:16](-[c:19]3[c:20]([C:25]#[N:26])[cH:21][cH:22][cH:23][cH:24]3)[cH:17][cH:18]2)[c:7]([CH2:9][CH2:10][CH3:11])[n:8]1.[CH3:92][CH2:93][O:94][C:95](=[O:96])[CH3:97].[O:72]=[C:73]([O:74][CH:75]([CH3:76])[CH3:77])[N:78]=[N:79][C:80]([O:81][CH:82]([CH3:83])[CH3:84])=[O:85].[O:86]1[CH2:87][CH2:88][CH2:89][CH2:90]1.[OH2:91].[c:53]1([P:54]([c:55]2[cH:56][cH:57][cH:58][cH:59][cH:60]2)[c:61]2[cH:62][cH:63][cH:64][cH:65][cH:66]2)[cH:67][cH:68][cH:69][cH:70][cH:71]1>>[CH2:1]([CH3:2])[c:3]1[n:4](-[c:28]2[cH:29][cH:30][c:31]([O:34][CH:47]3[CH2:46][CH2:45][CH:44]([C:41]([O:40][Si:39]([C:35]([CH3:36])([CH3:37])[CH3:38])([CH3:51])[CH3:52])([CH3:42])[CH3:43])[CH2:49][CH2:48]3)[cH:32][cH:33]2)[c:5](=[O:27])[c:6]([CH2:12][c:13]2[cH:14][cH:15][c:16](-[c:19]3[c:20]([C:25]#[N:26])[cH:21][cH:22][cH:23][cH:24]3)[cH:17][cH:18]2)[c:7]([CH2:9][CH2:10][CH3:11])[n:8]1

Participants

8

Reactant 7

HCID 962WaterHCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 11776TriphenylphosphineHCID 75555Diisopropyl diazene-1,2-dicarboxylateHCID 57460841HCID 57460841, compoundHCID 57464949HCID 57464949, compound

Product 1

HCID 574649524'-{[1-(4-{[trans-4-(1-{[Tert-butyl(dimethyl)silyl]oxy}-1-methylethyl)cyclohexyl]oxy}phenyl)-2-ethyl-6-oxo-4-propyl-1,6-dihydropyrimidin-5-yl]methyl}biphenyl-2-carbonitrile

Sources & evidence

ORD record
ord-59059b3934314c15ab37bbf24d2480df
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

Loading…