Acetic Acid → HCID 178482089, compound
Reaction equation
[C:34]([O:35][BH-:36]([O:37][C:38](=[O:39])[CH3:40])[O:41][C:42](=[O:43])[CH3:44])(=[O:45])[CH3:46].[CH3:1][N:2]([S:3](=[O:4])(=[O:5])[c:6]1[s:7][cH:8][cH:9][cH:10]1)[c:11]1[cH:12][cH:13][cH:14][c:15]2[cH:16][c:17]([C:20]3=[N:24][CH2:23][CH:22]([CH2:25][CH:26]=[O:27])[S:21]3)[nH:18][c:19]12.[CH3:53][C:54](=[O:55])[OH:56].[Na+:47].[Na+:48].[OH:49][C:50](=[O:51])[O-:52].[n:28]1[n:29][c:30]([NH2:33])[nH:31][cH:32]1>>[CH3:1][N:2]([S:3](=[O:4])(=[O:5])[c:6]1[s:7][cH:8][cH:9][cH:10]1)[c:11]1[cH:12][cH:13][cH:14][c:15]2[cH:16][c:17]([C:20]3=[N:24][CH2:23][CH:22]([CH2:25][CH2:26][NH:33][c:30]4[n:29][n:28][cH:32][nH:31]4)[S:21]3)[nH:18][c:19]12Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-e1bfa919be1440ef81a844f8e6a5d7f8
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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