Water → HCID 178422104, compound
Reaction equation
[CH3:23][S:24]([Cl:25])(=[O:26])=[O:27].[CH3:28][CH2:29][N:30]([CH2:31][CH3:32])[CH2:33][CH3:34].[CH:1]12[CH:2]([NH:8][C:9]3=[N:13][C:12](=[O:14])[C:11]([CH2:15][CH:16]4[CH2:17][CH2:18][NH:19][CH2:20][CH2:21]4)([CH3:22])[S:10]3)[CH2:3][CH:4]([CH2:5][CH2:6]1)[CH2:7]2.[Cl:36][CH2:37][Cl:38].[OH2:35]>>[CH:1]12[CH:2]([NH:8][C:9]3=[N:13][C:12](=[O:14])[C:11]([CH2:15][CH:16]4[CH2:17][CH2:18][N:19]([S:24]([CH3:23])(=[O:26])=[O:27])[CH2:20][CH2:21]4)([CH3:22])[S:10]3)[CH2:3][CH:4]([CH2:5][CH2:6]1)[CH2:7]2Participants
6
Sources & evidence
- ORD record
- ord-09c51358c8c34e278a1fd1ba2ab9feeb
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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