HCID 67067782, compound → 2-Methyl-propane-2-sulfinic acid {1-[5-(1-methyl-6-oxo-8-phenyl-1,6-dihydro-9-oxa-1,2-diaza-cyclopenta[a]naphthalen-7-yl)-pyridin-2-yl]-cyclobutyl}-amide
Reaction equation
[I:47][c:48]1[c:49](=[O:68])[c:50]2[cH:51][cH:52][c:53]3[c:54]([c:55]2[o:56][c:57]1-[c:58]1[cH:59][cH:60][cH:61][cH:62][cH:63]1)[n:64]([CH3:67])[n:65][cH:66]3.[O:1]=[c:2]1[n:3]2[cH:4][cH:5][c:6]3[c:7](=[O:8])[c:9](-[c:21]4[cH:22][cH:23][c:24]([C:27]5([NH:31][S:32](=[O:33])[C:34]([CH3:35])([CH3:36])[CH3:37])[CH2:28][CH2:29][CH2:30]5)[n:25][cH:26]4)[c:10](-[c:11]4[cH:12][cH:13][cH:14][cH:15][cH:16]4)[o:17][c:18]3[c:19]2[n:20][n:38]1[CH2:39][O:40][CH2:41][CH2:42][Si:43]([CH3:44])([CH3:45])[CH3:46]>>[c:21]1(-[c:48]2[c:49](=[O:68])[c:50]3[cH:51][cH:52][c:53]4[c:54]([c:55]3[o:56][c:57]2-[c:58]2[cH:59][cH:60][cH:61][cH:62][cH:63]2)[n:64]([CH3:67])[n:65][cH:66]4)[cH:22][cH:23][c:24]([C:27]2([NH:31][S:32](=[O:33])[C:34]([CH3:35])([CH3:36])[CH3:37])[CH2:28][CH2:29][CH2:30]2)[n:25][cH:26]1Participants
3
Sources & evidence
- ORD record
- ord-219ac81a78614abdb23e5df19370a9d2
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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