Acetone → HCID 178474407, compound
Reaction equation
[C:1]([CH3:2])(=[O:3])[NH:4][c:5]1[s:6][c:7]2[c:8]([n:9]1)[c:10]([O:14][c:15]1[cH:16][c:17](-[c:21]3[c:22]([NH:31][C:32](=[O:33])[CH:34]4[NH:35][CH2:36][CH2:37][CH2:38]4)[cH:23][c:24]([C:27]([F:28])([F:29])[F:30])[cH:25][cH:26]3)[n:18][cH:19][n:20]1)[cH:11][cH:12][cH:13]2.[CH3:39][C:40]([CH3:41])=[O:42]>>[C:1]([CH3:2])(=[O:3])[NH:4][c:5]1[s:6][c:7]2[c:8]([n:9]1)[c:10]([O:14][c:15]1[cH:16][c:17](-[c:21]3[c:22]([NH:31][C:32](=[O:33])[CH:34]4[N:35]([CH:40]([CH3:39])[CH3:41])[CH2:36][CH2:37][CH2:38]4)[cH:23][c:24]([C:27]([F:28])([F:29])[F:30])[cH:25][cH:26]3)[n:18][cH:19][n:20]1)[cH:11][cH:12][cH:13]2Participants
3
Sources & evidence
- ORD record
- ord-04eb71bfadb642ba810ce177e0e82368
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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