Chloride → HCID 178502123, compound
Reaction equation
[CH2:24]([N:25]([CH:26]([CH3:27])[CH3:28])[CH:29]([CH3:30])[CH3:31])[CH3:32].[CH3:1][O:2][C:3](=[O:4])[NH:5][CH2:6][CH2:7][N:8]1[C:9](=[O:23])[CH:10]([CH3:22])[S:11][c:12]2[c:13]1[cH:14][c:15]([C:19](=[O:20])[OH:21])[c:16]([CH3:18])[cH:17]2.[CH3:52][N:53]([CH3:54])[CH:55]=[O:56].[CH:33]([CH3:34])([CH3:35])[NH:36][CH:37]1[CH2:38][N:39]([C:43](=[O:44])[O:45][C:46]([CH3:47])([CH3:48])[CH3:49])[CH2:40][CH2:41][CH2:42]1.[Cl-:51].[Na+:50]>>[CH3:1][O:2][C:3](=[O:4])[NH:5][CH2:6][CH2:7][N:8]1[C:9](=[O:23])[CH:10]([CH3:22])[S:11][c:12]2[c:13]1[cH:14][c:15]([C:19](=[O:21])[N:36]([CH:33]([CH3:34])[CH3:35])[CH:37]1[CH2:38][N:39]([C:43](=[O:44])[O:45][C:46]([CH3:47])([CH3:48])[CH3:49])[CH2:40][CH2:41][CH2:42]1)[c:16]([CH3:18])[cH:17]2Participants
7
Sources & evidence
- ORD record
- ord-b3e67c67dadc4885aac2253c9bd073fe
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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