Water → HCID 59331549, compound
Reaction equation
[CH2:12]1[CH2:13][O:14][CH2:15][CH2:16][NH:17]1.[Cl:1][c:2]1[cH:3][c:4]([CH:5]=[O:6])[cH:7][cH:8][c:9]1[S:10][CH3:11].[K:30][C:31]#[N:32].[O:33]1[CH2:34][CH2:35][CH2:36][CH2:37]1.[OH2:18].[OH2:38].[c:19]1([CH3:20])[cH:21][cH:22][c:23]([S:24]([OH:25])(=[O:26])=[O:27])[cH:28][cH:29]1>>[Cl:1][c:2]1[cH:3][c:4]([CH:5]([N:17]2[CH2:12][CH2:13][O:14][CH2:15][CH2:16]2)[C:31]#[N:32])[cH:7][cH:8][c:9]1[S:10][CH3:11]Participants
7
Sources & evidence
- ORD record
- ord-93775154bc1a49dab3abb5a12e362979
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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