Hydrochloric Acid → N-[3-(1-ethyl-3,3,5-trimethyl-2,4-dioxo-2,3,4,5-tetrahydro-1H-benzo[b][1,4]diazepin-7-yloxy)propyl]-N-(2-pyridin-3-ylethyl)isonicotinamide
Reaction equation
[CH2:13]([CH3:14])[N:15]1[c:16]2[c:17]([cH:27][c:28]([O:31][CH2:32][CH2:33][CH2:34][NH:35][CH2:36][CH2:37][c:38]3[cH:39][n:40][cH:41][cH:42][cH:43]3)[cH:29][cH:30]2)[N:18]([CH3:26])[C:19](=[O:25])[C:20]([CH3:23])([CH3:24])[C:21]1=[O:22].[CH3:2][N:3]([CH3:4])[CH2:5][CH2:6][CH2:7][N:8]=[C:9]=[N:10][CH2:11][CH3:12].[CH3:63][C:64]#[N:65].[ClH:1].[OH:44][C:45](=[O:46])[c:47]1[cH:48][cH:49][n:50][cH:51][cH:52]1.[OH:53][n:54]1[c:55]2[cH:56][cH:57][cH:58][cH:59][c:60]2[n:61][n:62]1>>[CH2:13]([CH3:14])[N:15]1[c:16]2[c:17]([cH:27][c:28]([O:31][CH2:32][CH2:33][CH2:34][N:35]([CH2:36][CH2:37][c:38]3[cH:39][n:40][cH:41][cH:42][cH:43]3)[C:45](=[O:44])[c:47]3[cH:48][cH:49][n:50][cH:51][cH:52]3)[cH:29][cH:30]2)[N:18]([CH3:26])[C:19](=[O:25])[C:20]([CH3:23])([CH3:24])[C:21]1=[O:22]Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-e9ab1a88721e49e5a21b086a579338cc
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
Loading…