Toluene → HCID 16748464, compound
Reaction equation
[CH3:28][C:29](=[O:30])[O:31][C:32](=[O:33])[CH3:34].[CH3:35][c:36]1[cH:37][cH:38][cH:39][cH:40][cH:41]1.[F:1][C:2]([CH:3]1[CH2:4][CH:5]=[C:6]([c:9]2[cH:10][c:11]([O:15][c:16]3[cH:17][cH:18][cH:19][c:20]4[c:21]3[n:22][c:23]([NH2:25])[s:24]4)[n:12][cH:13][n:14]2)[CH2:7][CH2:8]1)([F:26])[F:27]>>[F:1][C:2]([CH:3]1[CH2:4][CH:5]=[C:6]([c:9]2[cH:10][c:11]([O:15][c:16]3[cH:17][cH:18][cH:19][c:20]4[c:21]3[n:22][c:23]([NH:25][C:29]([CH3:28])=[O:30])[s:24]4)[n:12][cH:13][n:14]2)[CH2:7][CH2:8]1)([F:26])[F:27]Participants
4
Sources & evidence
- ORD record
- ord-db7353d6b9a84a7ba77a9e7ac3d40167
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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