Water → HCID 9951182, compound
Reaction equation
[CH2:27]1[CH2:28][CH2:29][C:30]2=[N:35][CH2:34][CH2:33][CH2:32][N:31]2[CH2:36][CH2:37]1.[CH3:38][CH2:39][O:40][C:41]([CH3:42])=[O:43].[Cl:1][c:2]1[n:3][n:4][c:5]([NH:11][c:12]2[cH:13][cH:14][c:15]([Cl:18])[cH:16][cH:17]2)[c:6]2[c:7]1[s:8][cH:9][cH:10]2.[OH2:44].[n:19]1[cH:20][cH:21][c:22]([CH2:25][OH:26])[cH:23][cH:24]1>>[c:2]1([O:26][CH2:25][c:22]2[cH:21][cH:20][n:19][cH:24][cH:23]2)[n:3][n:4][c:5]([NH:11][c:12]2[cH:13][cH:14][c:15]([Cl:18])[cH:16][cH:17]2)[c:6]2[c:7]1[s:8][cH:9][cH:10]2Participants
6
Sources & evidence
- ORD record
- ord-dabb5aa6735e4c33bfe2e76246a87033
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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