Water → HCID 57884433, compound
Reaction equation
[C:39](=[O:40])([O-:41])[O-:42].[CH3:46][C:47](=[O:48])[CH2:49][CH3:50].[Cs+:43].[Cs+:44].[I:15][CH2:16][c:17]1[cH:18][cH:19][c:20]([CH:23]([c:24]2[cH:25][c:26]([C:27]#[N:28])[cH:29][cH:30][cH:31]2)[O:32][CH:33]2[O:34][CH2:35][CH2:36][CH2:37][CH2:38]2)[cH:21][cH:22]1.[OH2:45].[OH:1][c:2]1[c:3]([C:12]([CH3:13])=[O:14])[cH:4][cH:5][c:6]([SH:11])[c:7]1[CH2:8][CH2:9][CH3:10]>>[OH:1][c:2]1[c:3]([C:12]([CH3:13])=[O:14])[cH:4][cH:5][c:6]([S:11][CH2:16][c:17]2[cH:18][cH:19][c:20]([CH:23]([c:24]3[cH:25][c:26]([C:27]#[N:28])[cH:29][cH:30][cH:31]3)[O:32][CH:33]3[O:34][CH2:35][CH2:36][CH2:37][CH2:38]3)[cH:21][cH:22]2)[c:7]1[CH2:8][CH2:9][CH3:10]Participants
7
Sources & evidence
- ORD record
- ord-ad539f0eb6b24e71bf43e4081134fabf
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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