Chloride → HCID 178486499, compound
Reaction equation
[CH3:39][C:40]#[N:41].[CH3:42][CH2:43][OH:44].[Cl-:27].[ClH:38].[NH2:1][c:2]1[cH:3][cH:4][c:5]([C:8]2=[N:9][CH:10]3[CH2:11][CH2:12][N:13]([CH3:26])[CH2:14][CH:15]3[c:16]3[c:17]2[cH:18][c:19]([O:24][CH3:25])[c:20]([O:22][CH3:23])[cH:21]3)[cH:6][cH:7]1.[c:28]1([CH2:34][C:35](=[O:36])[OH:37])[cH:29][cH:30][cH:31][cH:32][cH:33]1>>[NH:1]([c:2]1[cH:3][cH:4][c:5]([C:8]2=[N:9][CH:10]3[CH2:11][CH2:12][N:13]([CH3:26])[CH2:14][CH:15]3[c:16]3[c:17]2[cH:18][c:19]([O:24][CH3:25])[c:20]([O:22][CH3:23])[cH:21]3)[cH:6][cH:7]1)[C:35]([CH2:34][c:28]1[cH:29][cH:30][cH:31][cH:32][cH:33]1)=[O:36]Participants
7
Sources & evidence
- ORD record
- ord-739faee069b94614999858379f3b6305
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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