Tetrahydrofuran → 4-(3-Chloro-4-fluorophenyl)-3-(4-{[2-(tritylamino)ethyl]amino}-1,2,5-oxadiazol-3-yl)-1,2,4-oxadiazol-5(4H)-one

HRID 1131596Notes

Reaction equation

HRID 1131596 reaction equation
[C:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)([c:8]1[cH:9][cH:10][cH:11][cH:12][cH:13]1)([c:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1)[NH:20][CH2:21][CH2:22][OH:23].[CH3:88][O:89][C:90]([CH3:91])([CH3:92])[CH3:93].[Cl:57][c:58]1[cH:59][c:60](-[n:65]2[c:66](-[c:71]3[c:72]([NH:76][C:77](=[O:78])[C:79]([F:80])([F:81])[F:82])[n:73][o:74][n:75]3)[n:67][o:68][c:69]2=[O:70])[cH:61][cH:62][c:63]1[F:64].[O:43]=[C:44]([O:45][CH:46]([CH3:47])[CH3:48])[N:49]=[N:50][C:51]([O:52][CH:53]([CH3:54])[CH3:55])=[O:56].[O:83]1[CH2:84][CH2:85][CH2:86][CH2:87]1.[c:24]1([P:25]([c:26]2[cH:27][cH:28][cH:29][cH:30][cH:31]2)[c:32]2[cH:33][cH:34][cH:35][cH:36][cH:37]2)[cH:38][cH:39][cH:40][cH:41][cH:42]1>>[C:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)([c:8]1[cH:9][cH:10][cH:11][cH:12][cH:13]1)([c:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1)[NH:20][CH2:21][CH2:22][NH:76][c:72]1[c:71](-[c:66]2[n:65](-[c:60]3[cH:59][c:58]([Cl:57])[c:63]([F:64])[cH:62][cH:61]3)[c:69](=[O:70])[o:68][n:67]2)[n:75][o:74][n:73]1

Participants

7

Reactant 6

HCID 8028TetrahydrofuranHCID 11776TriphenylphosphineHCID 15413tert-Butyl methyl etherHCID 75555Diisopropyl diazene-1,2-dicarboxylateHCID 31256082-((Triphenylmethyl)amino)ethanolHCID 86638008N-{4-[4-(3-Chloro-4-fluorophenyl)-5-oxo-4,5-dihydro-1,2,4-oxadiazol-3-yl]-1,2,5-oxadiazol-3-yl}-2,2,2-trifluoroacetamide

Product 1

HCID 666063854-(3-Chloro-4-fluorophenyl)-3-(4-{[2-(tritylamino)ethyl]amino}-1,2,5-oxadiazol-3-yl)-1,2,4-oxadiazol-5(4H)-one

Sources & evidence

ORD record
ord-e0f1119753ea421883119176ff56055c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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