Water → HCID 58014495, compound
Reaction equation
[CH2:49]1[O:50][CH2:51][CH2:52][O:53][CH2:54]1.[CH3:55][C:56]#[N:57].[Cl:1][c:2]1[n:3][cH:4][cH:5][c:6](-[c:8]2[cH:9][n:10][n:11]([C:13]3([CH2:23][C:24]#[N:25])[CH2:14][N:15]([S:17](=[O:18])(=[O:19])[CH:20]4[CH2:21][CH2:22]4)[CH2:16]3)[cH:12]2)[n:7]1.[OH2:58].[c:38]1([CH3:39])[cH:40][cH:41][c:42]([S:43]([OH:44])(=[O:45])=[O:46])[cH:47][cH:48]1.[n:26]1(-[c:31]2[cH:32][cH:33][c:34]([NH2:35])[cH:36][cH:37]2)[n:27][cH:28][cH:29][cH:30]1>>[c:2]1([NH:35][c:34]2[cH:33][cH:32][c:31](-[n:26]3[n:27][cH:28][cH:29][cH:30]3)[cH:37][cH:36]2)[n:3][cH:4][cH:5][c:6](-[c:8]2[cH:9][n:10][n:11]([C:13]3([CH2:23][C:24]#[N:25])[CH2:14][N:15]([S:17](=[O:18])(=[O:19])[CH:20]4[CH2:21][CH2:22]4)[CH2:16]3)[cH:12]2)[n:7]1Participants
7
Sources & evidence
- ORD record
- ord-4aa804a4f14143a3a9c44eccf4cf595f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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