1,4-Dioxane → 4-(5-methoxy-1H-indol-3-yl)piperidine-1-carboxylic acid-(4-dimethylamino-4-phenylcyclohexyl)-amide
Reaction equation
[CH3:26][O:27][c:28]1[cH:29][c:30]2[c:31]([CH:37]3[CH2:38][CH2:39][NH:40][CH2:41][CH2:42]3)[cH:32][nH:33][c:34]2[cH:35][cH:36]1.[O:43]1[CH2:44][CH2:45][O:46][CH2:47][CH2:48]1.[c:1]1([O:2][C:8]([NH:9][CH:10]2[CH2:11][CH2:12][C:13]([c:16]3[cH:17][cH:18][cH:19][cH:20][cH:21]3)([N:22]([CH3:23])[CH3:24])[CH2:14][CH2:15]2)=[O:25])[cH:3][cH:4][cH:5][cH:6][cH:7]1>>[C:8]([NH:9][CH:10]1[CH2:11][CH2:12][C:13]([c:16]2[cH:17][cH:18][cH:19][cH:20][cH:21]2)([N:22]([CH3:23])[CH3:24])[CH2:14][CH2:15]1)(=[O:25])[N:40]1[CH2:39][CH2:38][CH:37]([c:31]2[c:30]3[cH:29][c:28]([O:27][CH3:26])[cH:36][cH:35][c:34]3[nH:33][cH:32]2)[CH2:42][CH2:41]1Participants
4
Sources & evidence
- ORD record
- ord-b1b40e5de0a8460bbd834fa6a65c187c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)