Ethyl Acetate → HCID 57436052, compound
Reaction equation
[CH3:12][S:13][CH2:14][CH2:15][NH2:16].[CH3:26][N:27]1[CH2:28][CH2:29][CH2:30][C:31]1=[O:32].[CH3:33][CH2:34][O:35][C:36](=[O:37])[CH3:38].[CH:17]([N:18]([CH2:19][CH3:20])[CH:21]([CH3:22])[CH3:23])([CH3:24])[CH3:25].[Cl:1][c:2]1[c:3]([CH3:11])[cH:4][cH:5][cH:6][c:7]1[N+:8](=[O:9])[O-:10]>>[c:2]1([NH:16][CH2:15][CH2:14][S:13][CH3:12])[c:3]([CH3:11])[cH:4][cH:5][cH:6][c:7]1[N+:8](=[O:9])[O-:10]Participants
6
Sources & evidence
- ORD record
- ord-b3d8285d35b64bda97b4121e6bf593a3
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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