N-cyano-O-phenyl-N'-[4-[3-(piperidinomethyl)phenoxy]butyl]isourea → N-cyano-N'-[3-[N-[2-[N-(4-fluorobenzyl)-N-(2-pyridyl)amino]ethyl]-N-methylamino]propyl]-N"-[4-[3-(piperidinomethyl)phenoxy]butyl]guanidine
Reaktionsgleichung
[C:24](#[N:25])[NH:26][C:27]([O:28][c:29]1[cH:30][cH:31][cH:32][cH:33][cH:34]1)=[N:35][CH2:36][CH2:37][CH2:38][CH2:39][O:40][c:41]1[cH:42][c:43]([CH2:47][N:48]2[CH2:49][CH2:50][CH2:51][CH2:52][CH2:53]2)[cH:44][cH:45][cH:46]1.[F:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][N:7]([c:8]2[n:9][cH:10][cH:11][cH:12][cH:13]2)[CH2:14][CH2:15][N:16]([CH2:17][CH2:18][CH2:19][NH2:20])[CH3:21])[cH:22][cH:23]1>>[F:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][N:7]([c:8]2[n:9][cH:10][cH:11][cH:12][cH:13]2)[CH2:14][CH2:15][N:16]([CH2:17][CH2:18][CH2:19][NH:20][C:27]([NH:26][C:24]#[N:25])=[N:35][CH2:36][CH2:37][CH2:38][CH2:39][O:40][c:41]2[cH:42][c:43]([CH2:47][N:48]3[CH2:49][CH2:50][CH2:51][CH2:52][CH2:53]3)[cH:44][cH:45][cH:46]2)[CH3:21])[cH:22][cH:23]1Komponenten
3
Edukt 2
Produkt 1
Quellen und Nachweise
- ORD-Eintrag
- ord-d57e500ff0734fbdb3c17459271f1631
- Quelldatensatz
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)