Acetic Acid → HCID 12521666, compound
Reaction equation
[CH3:18][N:19]1[CH2:20][CH2:21][NH:22][CH2:23][CH2:24]1.[CH3:25][C:26](=[O:27])[OH:28].[Cl:1][c:2]1[cH:3][c:4]2[c:5]([cH:16][cH:17]1)[N:6]=[C:7]([S:14][CH3:15])[c:8]1[c:9]([cH:11][s:12][cH:13]1)[NH:10]2>>[Cl:1][c:2]1[cH:3][c:4]2[c:5]([cH:16][cH:17]1)[N:6]=[C:7]([N:22]1[CH2:21][CH2:20][N:19]([CH3:18])[CH2:24][CH2:23]1)[c:8]1[c:9]([cH:11][s:12][cH:13]1)[NH:10]2Participants
4
Sources & evidence
- ORD record
- ord-25519917973e4da49fd244baaff801d0
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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