Ethanol → HCID 11453978, compound
Reaction equation
[CH3:44][CH2:45][OH:46].[NH2:42][NH2:43].[c:1]1([S:7](=[O:8])(=[O:9])[C:10]([c:11]2[n:12][c:13]([CH2:16][N:17]3[C:18](=[O:19])[c:20]4[c:21]([cH:22][cH:23][cH:24][cH:25]4)[C:26]3=[O:27])[n:14][o:15]2)([F:28])[CH:29]2[CH2:30][c:31]3[c:32]([nH:33][c:34]4[cH:35][cH:36][c:37]([Cl:40])[cH:38][c:39]34)[CH2:41]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([S:7](=[O:8])(=[O:9])[C:10]([c:11]2[n:12][c:13]([CH2:16][NH2:17])[n:14][o:15]2)([F:28])[CH:29]2[CH2:30][c:31]3[c:32]([nH:33][c:34]4[cH:35][cH:36][c:37]([Cl:40])[cH:38][c:39]34)[CH2:41]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1Participants
4
Sources & evidence
- ORD record
- ord-b14676884aa047698890875cfc517528
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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