Water → HCID 68491707, compound
Reaction equation
[CH3:41][S:42]([Cl:43])(=[O:44])=[O:45].[Cl:47][CH2:48][Cl:49].[NH2:1][c:2]1[c:3]2[c:7]([c:8](-[c:11]3[n:12]([C:27](=[O:28])[O:29][C:30]([CH3:31])([CH3:32])[CH3:33])[c:13]4[cH:14][cH:15][c:16]([CH2:20][N:21]5[CH2:22][CH2:23][CH2:24][CH2:25][CH2:26]5)[cH:17][c:18]4[cH:19]3)[cH:9][cH:10]1)[C:6](=[O:34])[NH:5][CH2:4]2.[OH2:46].[cH:35]1[cH:36][cH:37][n:38][cH:39][cH:40]1>>[NH:1]([c:2]1[c:3]2[c:7]([c:8](-[c:11]3[n:12]([C:27](=[O:28])[O:29][C:30]([CH3:31])([CH3:32])[CH3:33])[c:13]4[cH:14][cH:15][c:16]([CH2:20][N:21]5[CH2:22][CH2:23][CH2:24][CH2:25][CH2:26]5)[cH:17][c:18]4[cH:19]3)[cH:9][cH:10]1)[C:6](=[O:34])[NH:5][CH2:4]2)[S:42]([CH3:41])(=[O:44])=[O:45]Participants
6
Sources & evidence
- ORD record
- ord-59a6c459a96a4226adf89c432088f0b2
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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