Diethyl Sulfate → HCID 57460766, compound
Reaction equation
[C:25](=[O:26])([O-:27])[O-:28].[CH3:40][N:41]([CH3:42])[CH:43]=[O:44].[CH3:45][CH2:46][O:47][C:48](=[O:49])[CH3:50].[Cs+:29].[Cs+:30].[OH:1][c:2]1[n:3][c:4]([CH3:24])[nH:5][c:6](=[O:23])[c:7]1[CH2:8][c:9]1[cH:10][cH:11][c:12](-[c:15]2[c:16]([C:21]#[N:22])[cH:17][cH:18][cH:19][cH:20]2)[cH:13][cH:14]1.[S:31]([O:32][CH2:33][CH3:34])([O:37][CH2:35][CH3:36])(=[O:38])=[O:39]>>[O:1]([c:2]1[n:3][c:4]([CH3:24])[nH:5][c:6](=[O:23])[c:7]1[CH2:8][c:9]1[cH:10][cH:11][c:12](-[c:15]2[c:16]([C:21]#[N:22])[cH:17][cH:18][cH:19][cH:20]2)[cH:13][cH:14]1)[CH2:35][CH3:36]Participants
7
Sources & evidence
- ORD record
- ord-eb7cf0738c604de9855d1963be327412
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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