Ethanol → HCID 178503886, compound
Reaction equation
[CH3:30][S:31][C:32]([S:33][CH3:34])=[N:35][C:36]#[N:37].[CH3:38][CH2:39][OH:40].[F:1][CH:2]([O:3][c:4]1[cH:5][c:6]([CH:14]([CH2:15][c:16]2[cH:17][cH:18][n:19][cH:20][cH:21]2)[c:22]2[cH:23][cH:24][c:25]([NH2:26])[cH:27][cH:28]2)[cH:7][cH:8][c:9]1[O:10][CH:11]([F:12])[F:13])[F:29]>>[F:1][CH:2]([O:3][c:4]1[cH:5][c:6]([CH:14]([CH2:15][c:16]2[cH:17][cH:18][n:19][cH:20][cH:21]2)[c:22]2[cH:23][cH:24][c:25]([NH:26][C:32]([S:31][CH3:30])=[N:35][C:36]#[N:37])[cH:27][cH:28]2)[cH:7][cH:8][c:9]1[O:10][CH:11]([F:12])[F:13])[F:29]Participants
4
Sources & evidence
- ORD record
- ord-2735c7f74eb64846bb9c8f5231f341f2
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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