Hydrochloric Acid → 2-[3-[(4-ethylsulfanyl-1H-indazol-5-yl)oxy]cyclohexyl]isoindole-1,3-dione
Reaction equation
[CH2:20]([CH3:21])[S:22][c:23]1[c:24]2[cH:25][n:26][nH:27][c:28]2[cH:29][cH:30][c:31]1[O:32][CH:33]1[CH2:34][CH2:35][CH:36]([NH2:37])[CH2:38][CH2:39]1.[CH2:40]([S:41][c:42]1[c:43]([OH:44])[cH:45][cH:46][c:47]2[c:48]1[cH:49][n:50][nH:51]2)[CH3:52].[ClH:19].[OH:1][CH:2]1[CH2:3][CH:4]([N:8]2[C:9](=[O:18])[c:10]3[cH:11][cH:12][cH:13][cH:14][c:15]3[C:16]2=[O:17])[CH2:5][CH2:6][CH2:7]1>>[O:1]([CH:2]1[CH2:3][CH:4]([N:8]2[C:9](=[O:18])[c:10]3[cH:11][cH:12][cH:13][cH:14][c:15]3[C:16]2=[O:17])[CH2:5][CH2:6][CH2:7]1)[c:31]1[c:23]([S:22][CH2:20][CH3:21])[c:24]2[cH:25][n:26][nH:27][c:28]2[cH:29][cH:30]1Participants
5
Sources & evidence
- ORD record
- ord-3d4a75bd4b314d0cbfac4731fc0c920e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
Loading…