Hydrochloric Acid → HCID 66939708, compound
Reaction equation
[CH3:40][N:41]([CH3:42])[CH2:43][CH2:44][CH2:45][N:46]=[C:47]=[N:48][CH2:49][CH3:50].[CH3:61][CH2:62][N:63]([CH2:64][CH3:65])[CH2:66][CH3:67].[CH3:68][N:69]([CH3:70])[CH:71]=[O:72].[ClH:1].[NH2:2][CH2:3][c:4]1[cH:5][c:6](-[c:14]2[s:15][c:16]([CH3:30])[c:17]([CH2:19][n:20]3[n:21][cH:22][c:23]([C:25](=[O:26])[O:27][CH2:28][CH3:29])[cH:24]3)[n:18]2)[cH:7][c:8]([C:10]([F:11])([F:12])[F:13])[cH:9]1.[OH2:73].[OH:51][n:52]1[c:53]2[cH:54][cH:55][cH:56][cH:57][c:58]2[n:59][n:60]1.[n:31]1[c:32]([C:37](=[O:38])[OH:39])[cH:33][cH:34][cH:35][cH:36]1>>[NH:2]([CH2:3][c:4]1[cH:5][c:6](-[c:14]2[s:15][c:16]([CH3:30])[c:17]([CH2:19][n:20]3[n:21][cH:22][c:23]([C:25](=[O:26])[O:27][CH2:28][CH3:29])[cH:24]3)[n:18]2)[cH:7][c:8]([C:10]([F:11])([F:12])[F:13])[cH:9]1)[C:37]([c:32]1[n:31][cH:36][cH:35][cH:34][cH:33]1)=[O:38]Participants
9
Sources & evidence
- ORD record
- ord-028cae0e89884e7f901a7fe2d28a777b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
Loading…