Ethanol → HCID 19831123, compound
Reaction equation
[CH3:30][CH2:31][OH:32].[Cl:26][CH2:27][C:28]#[N:29].[SH:1][CH2:2][C:3]1=[C:8]([C:9](=[O:10])[O:11][CH2:12][CH3:13])[CH:7]([c:14]2[cH:15][c:16]([N+:20](=[O:21])[O-:22])[cH:17][cH:18][cH:19]2)[C:6]([C:23]#[N:24])=[C:5]([CH3:25])[NH:4]1>>[S:1]([CH2:2][C:3]1=[C:8]([C:9](=[O:10])[O:11][CH2:12][CH3:13])[CH:7]([c:14]2[cH:15][c:16]([N+:20](=[O:21])[O-:22])[cH:17][cH:18][cH:19]2)[C:6]([C:23]#[N:24])=[C:5]([CH3:25])[NH:4]1)[CH2:27][C:28]#[N:29]Participants
4
Sources & evidence
- ORD record
- ord-f8fe47d8333e438baf6858e90c2809fa
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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