Dimethyl Sulfoxide → N-{[1,6-Diethyl-4-(tetrahydro-2H-pyran-4-ylamino)-1H-pyrazolo[3,4-b]pyridin-5-yl]methyl}-N'-({3'-[(3,5-dimethyl-1-piperazinyl)methyl]-6-fluoro-3-biphenylyl}methyl)pentanediamide
Reaction equation
[CH2:1]([CH3:2])[n:3]1[n:4][cH:5][c:6]2[c:7]1[n:8][c:9]([CH2:45][CH3:46])[c:10]([CH2:19][NH:20][C:21]([CH2:22][CH2:23][CH2:24][C:25](=[O:26])[NH:27][CH2:28][c:29]1[cH:30][c:31](-[c:36]3[cH:37][c:38]([CH:42]=[O:43])[cH:39][cH:40][cH:41]3)[c:32]([F:35])[cH:33][cH:34]1)=[O:44])[c:11]2[NH:12][CH:13]1[CH2:14][CH2:15][O:16][CH2:17][CH2:18]1.[CH3:47][CH:48]1[NH:49][CH:50]([CH3:54])[CH2:51][NH:52][CH2:53]1.[CH3:55][S:56]([CH3:57])=[O:58]>>[CH2:1]([CH3:2])[n:3]1[n:4][cH:5][c:6]2[c:7]1[n:8][c:9]([CH2:45][CH3:46])[c:10]([CH2:19][NH:20][C:21]([CH2:22][CH2:23][CH2:24][C:25](=[O:26])[NH:27][CH2:28][c:29]1[cH:30][c:31](-[c:36]3[cH:37][c:38]([CH2:42][N:52]4[CH2:51][CH:50]([CH3:54])[NH:49][CH:48]([CH3:47])[CH2:53]4)[cH:39][cH:40][cH:41]3)[c:32]([F:35])[cH:33][cH:34]1)=[O:44])[c:11]2[NH:12][CH:13]1[CH2:14][CH2:15][O:16][CH2:17][CH2:18]1Participants
4
Reactant 3
Product 1
Sources & evidence
- ORD record
- ord-7848acb1ad78490cbe1533144ef43b41
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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