Water → Tert-butyl 4-[4-[5-[(1-methoxy-4-methyl-1-oxopentan-2-yl)-(2,2,2-trichloroethoxycarbonyl)amino]-3-methyl-1,2-oxazol-4-yl]phenyl]piperazine-1-carboxylate

HRID 1232625Notizen

Reaktionsgleichung

Reaktionsgleichung von HRID 1232625
[CH3:1][c:2]1[n:3][o:4][c:5]([NH:26][C:27](=[O:28])[O:29][CH2:30][C:31]([Cl:32])([Cl:33])[Cl:34])[c:6]1-[c:7]1[cH:8][cH:9][c:10]([N:13]2[CH2:14][CH2:15][N:16]([C:19](=[O:20])[O:21][C:22]([CH3:23])([CH3:24])[CH3:25])[CH2:17][CH2:18]2)[cH:11][cH:12]1.[O:64]=[C:65]([O:66][CH:67]([CH3:68])[CH3:69])[N:70]=[N:71][C:72]([O:73][CH:74]([CH3:75])[CH3:76])=[O:77].[O:78]=[CH:79][N:80]([CH3:81])[CH3:82].[OH2:83].[OH:35][CH:36]([C:37](=[O:38])[O:39][CH3:40])[CH2:41][CH:42]([CH3:43])[CH3:44].[c:45]1([P:46]([c:47]2[cH:48][cH:49][cH:50][cH:51][cH:52]2)[c:53]2[cH:54][cH:55][cH:56][cH:57][cH:58]2)[cH:59][cH:60][cH:61][cH:62][cH:63]1>>[CH3:1][c:2]1[n:3][o:4][c:5]([N:26]([C:27](=[O:28])[O:29][CH2:30][C:31]([Cl:32])([Cl:33])[Cl:34])[CH:36]([C:37](=[O:38])[O:39][CH3:40])[CH2:41][CH:42]([CH3:43])[CH3:44])[c:6]1-[c:7]1[cH:8][cH:9][c:10]([N:13]2[CH2:14][CH2:15][N:16]([C:19](=[O:20])[O:21][C:22]([CH3:23])([CH3:24])[CH3:25])[CH2:17][CH2:18]2)[cH:11][cH:12]1

Komponenten

7

Edukt 6

HCID 962WaterHCID 6228DimethylformamideHCID 11776TriphenylphosphineHCID 62908Methyl 2-hydroxy-4-methylpentanoateHCID 75555Diisopropyl diazene-1,2-dicarboxylateHCID 22235871Tert-butyl 4-[4-(3-methyl-5-{[(2,2,2-trichloroethoxy)carbonyl]amino}isoxazol-4-yl)phenyl]piperazine-1-carboxylate

Produkt 1

HCID 22235802Tert-butyl 4-[4-[5-[(1-methoxy-4-methyl-1-oxopentan-2-yl)-(2,2,2-trichloroethoxycarbonyl)amino]-3-methyl-1,2-oxazol-4-yl]phenyl]piperazine-1-carboxylate

Quellen und Nachweise

ORD-Eintrag
ord-bb3e2d777a9c4a4d8cea9b449d8d777c
Quelldatensatz
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

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