2-Butyne-1,4-diol → HCID 178450875, compound
Reaction equation
[CH2:26]([C:27]#[C:28][CH2:29][OH:30])[OH:31].[OH:1][c:2]1[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[N:11]2[CH:12]([C:19](=[O:20])[O:21][C:22]([CH3:23])([CH3:24])[CH3:25])[C:13]([CH3:17])([CH3:18])[S:14][CH2:15][CH2:16]2)[cH:6][cH:7]1>>[O:1]([c:2]1[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[N:11]2[CH:12]([C:19](=[O:20])[O:21][C:22]([CH3:23])([CH3:24])[CH3:25])[C:13]([CH3:17])([CH3:18])[S:14][CH2:15][CH2:16]2)[cH:6][cH:7]1)[CH2:26][C:27]#[C:28][CH2:29][OH:30]Participants
3
Sources & evidence
- ORD record
- ord-bdf0a6d507c74152b3f88f275731adb3
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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