Ethanol → HCID 136054519, compound
Reaction equation
[CH3:43][CH2:44][OH:45].[NH2:1][CH2:2][c:3]1[cH:4][c:5](-[c:9]2[cH:10][cH:11][c:12]([S:15](=[O:16])(=[O:17])[NH:18][CH:19]([CH:20]([CH3:21])[CH3:22])[C:23](=[O:24])[O:25][CH3:26])[cH:13][cH:14]2)[cH:6][cH:7][cH:8]1.[O:27]=[c:28]1[nH:29][c:30]([C:38](=[O:39])[O:40][CH2:41][CH3:42])[n:31][c:32]2[cH:33][cH:34][cH:35][cH:36][c:37]12>>[NH:1]([CH2:2][c:3]1[cH:4][c:5](-[c:9]2[cH:10][cH:11][c:12]([S:15](=[O:16])(=[O:17])[NH:18][CH:19]([CH:20]([CH3:21])[CH3:22])[C:23](=[O:24])[O:25][CH3:26])[cH:13][cH:14]2)[cH:6][cH:7][cH:8]1)[C:38]([c:30]1[nH:29][c:28](=[O:27])[c:37]2[c:32]([n:31]1)[cH:33][cH:34][cH:35][cH:36]2)=[O:39]Participants
4
Sources & evidence
- ORD record
- ord-7cf0f98fa75f4a92bcf94d7c093b79c4
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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