Dimethylformamide → N-(9-oxo-2-phenyl-3,10,11-triazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13),11-pentaen-6-yl)piperidine-2-carboxamide
Reaktionsgleichung
[C:1]([O:2][C:3](=[O:4])[N:8]1[CH:9]([C:14]([NH:15][c:16]2[cH:17][c:18]3[c:19]4[c:20]([c:21](-[c:25]5[cH:26][cH:27][cH:28][cH:29][cH:30]5)[nH:22][c:23]4[cH:24]2)[cH:31][n:32][nH:33][c:34]3=[O:35])=[O:36])[CH2:10][CH2:11][CH2:12][CH2:13]1)([CH3:5])([CH3:6])[CH3:7].[C:37]([O:38][C:39]([N:40]1[CH2:41][CH2:42][CH2:43][CH2:44][CH:45]1[C:46]([OH:47])=[O:48])=[O:49])([CH3:50])([CH3:51])[CH3:52].[CH3:53][CH2:54][N:55]([CH2:56][CH3:57])[CH2:58][CH3:59].[CH3:84][N:85]([CH3:86])[CH:87]=[O:88].[P-:60]([F:61])([F:62])([F:63])([F:64])([F:65])[F:66].[n:67]1([O:68][C:69]([N:70]([CH3:71])[CH3:72])=[N+:73]([CH3:74])[CH3:75])[c:76]2[n:77][cH:78][cH:79][cH:80][c:81]2[n:82][n:83]1>>[NH:8]1[CH:9]([C:14]([NH:15][c:16]2[cH:17][c:18]3[c:19]4[c:20]([c:21](-[c:25]5[cH:26][cH:27][cH:28][cH:29][cH:30]5)[nH:22][c:23]4[cH:24]2)[cH:31][n:32][nH:33][c:34]3=[O:35])=[O:36])[CH2:10][CH2:11][CH2:12][CH2:13]1Komponenten
7
Edukt 6
Produkt 1
Quellen und Nachweise
- ORD-Eintrag
- ord-1954543cabcc4ae8b752a1cad832c626
- Quelldatensatz
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
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