Acetic Acid → HCID 58840817, compound
Reaction equation
[CH3:1][NH:2][C:3](=[O:4])[C:5]1([n:15]2[c:16]3[n:17][c:18]([Cl:33])[n:19][c:20]([NH:24][CH2:25][c:26]4[cH:27][c:28]([I:32])[cH:29][cH:30][cH:31]4)[c:21]3[n:22][cH:23]2)[S:6][CH2:7][CH:8]2[O:9][C:10]([CH3:13])([CH3:14])[O:11][CH:12]12.[CH3:34][C:35](=[O:36])[OH:37]>>[CH3:1][NH:2][C:3](=[O:4])[C:5]1([n:15]2[c:16]3[n:17][c:18]([Cl:33])[n:19][c:20]([NH:24][CH2:25][c:26]4[cH:27][c:28]([I:32])[cH:29][cH:30][cH:31]4)[c:21]3[n:22][cH:23]2)[S:6][CH2:7][CH:8]([OH:9])[CH:12]1[OH:11]Participants
3
Sources & evidence
- ORD record
- ord-3b3a5db499194d2ead9453c423a7d5dd
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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