Tetrahydrofuran → HCID 69692578, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([CH2:7][CH:8]([C:9](=[O:10])[NH2:11])[NH:12][S:13](=[O:14])(=[O:15])[c:16]1[c:17]([O:26][CH2:27][CH2:28][c:29]2[c:30]3[cH:31][cH:32][cH:33][n:34][c:35]3[cH:36][cH:37][cH:38]2)[cH:18][c:19]([NH:22][C:23]([CH3:24])=[O:25])[cH:20][cH:21]1)=[O:39].[CH2:60]1[O:61][CH2:62][CH2:63][CH2:64]1.[CH3:40][CH2:41][N:42]([CH2:43][CH3:44])[CH2:45][CH3:46].[F:47][C:48]([F:49])([F:50])[C:51]([O:52][C:53](=[O:54])[C:55]([F:56])([F:57])[F:58])=[O:59]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([CH2:7][CH:8]([C:9]#[N:11])[NH:12][S:13](=[O:14])(=[O:15])[c:16]1[c:17]([O:26][CH2:27][CH2:28][c:29]2[c:30]3[cH:31][cH:32][cH:33][n:34][c:35]3[cH:36][cH:37][cH:38]2)[cH:18][c:19]([NH:22][C:23]([CH3:24])=[O:25])[cH:20][cH:21]1)=[O:39]Participants
5
Sources & evidence
- ORD record
- ord-86c83928def046d2aa1de9cab1579dec
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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