Hydrochloric Acid → HCID 44481137, compound
Reaction equation
[CH3:53][S:54]([CH3:55])=[O:56].[CH:44]([N:45]([CH2:46][CH3:47])[CH:48]([CH3:49])[CH3:50])([CH3:51])[CH3:52].[Cl:1][c:2]1[n:3][c:4](-[c:21]2[c:22]([Cl:28])[cH:23][c:24]([Cl:27])[cH:25][cH:26]2)[cH:5][c:6]2[n:7]1[n:8][c:9]([CH:11]1[CH2:12][CH2:13][N:14]([CH2:17][CH:18]3[CH2:19][CH2:20]3)[CH2:15][CH2:16]1)[n:10]2.[ClH:29].[ClH:30].[NH2:31][c:32]1[n:33][c:34]([NH:40][CH2:41][CH2:42][NH2:43])[cH:35][cH:36][c:37]1[C:38]#[N:39]>>[c:2]1([NH:43][CH2:42][CH2:41][NH:40][c:34]2[n:33][c:32]([NH2:31])[c:37]([C:38]#[N:39])[cH:36][cH:35]2)[n:3][c:4](-[c:21]2[c:22]([Cl:28])[cH:23][c:24]([Cl:27])[cH:25][cH:26]2)[cH:5][c:6]2[n:7]1[n:8][c:9]([CH:11]1[CH2:12][CH2:13][N:14]([CH2:17][CH:18]3[CH2:19][CH2:20]3)[CH2:15][CH2:16]1)[n:10]2Participants
6
Sources & evidence
- ORD record
- ord-f3efc6dc35e34e759f945940b3de833d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
Loading…