Bicarbonate Ion → 8-(2,6-Difluoro-3,5-dimethoxy-phenyl)-quinoxaline-5-carboxylic acid [5-(3,3,4-trimethyl-piperazin-1-ylmethyl)-pyridin-2-yl]-amide
Reaction equation
[CH2:1]([O:2][C:4](=[O:5])[c:6]1[c:7]2[n:8][cH:9][cH:10][n:11][c:12]2[c:13](-[c:16]2[c:17]([F:27])[c:18]([O:25][CH3:26])[cH:19][c:20]([O:23][CH3:24])[c:21]2[F:22])[cH:14][cH:15]1)[CH3:3].[CH3:28][C:29]1([CH3:44])[CH2:30][N:31]([CH2:36][c:37]2[cH:38][cH:39][c:40]([NH2:43])[n:41][cH:42]2)[CH2:32][CH2:33][N:34]1[CH3:35].[Cl:50][CH2:51][Cl:52].[Na+:49].[O-:45][C:46]([OH:47])=[O:48]>>[C:4](=[O:5])([c:6]1[c:7]2[n:8][cH:9][cH:10][n:11][c:12]2[c:13](-[c:16]2[c:17]([F:27])[c:18]([O:25][CH3:26])[cH:19][c:20]([O:23][CH3:24])[c:21]2[F:22])[cH:14][cH:15]1)[NH:43][c:40]1[cH:39][cH:38][c:37]([CH2:36][N:31]2[CH2:30][C:29]([CH3:28])([CH3:44])[N:34]([CH3:35])[CH2:33][CH2:32]2)[cH:42][n:41]1Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-3c3160d6df1a4b64a3f747d5cee1e0ea
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
Loading…