Acetic Acid → N2-(5-Ethynyl-2-isopropoxy-4-methyl-phenyl)-5-methyl-N4-[2-(propane-2-sulfonyl)-phenyl]-pyrimidine-2,4-diamine
Reaction equation
[C:57]([OH:58])(=[O:59])[CH3:60].[CH2:40]([N+:41]([CH2:42][CH2:43][CH2:44][CH3:45])([CH2:46][CH2:47][CH2:48][CH3:49])[CH2:50][CH2:51][CH2:52][CH3:53])[CH2:54][CH2:55][CH3:56].[CH2:61]1[O:62][CH2:63][CH2:64][CH2:65]1.[CH:1]([CH3:2])([CH3:3])[O:4][c:5]1[c:6]([NH:18][c:19]2[n:20][cH:21][c:22]([CH3:38])[c:23]([NH:25][c:26]3[c:27]([S:32](=[O:33])(=[O:34])[CH:35]([CH3:36])[CH3:37])[cH:28][cH:29][cH:30][cH:31]3)[n:24]2)[cH:7][c:8]([C:12]#[C:13][Si:14]([CH3:15])([CH3:16])[CH3:17])[c:9]([CH3:11])[cH:10]1.[F-:39]>>[CH:1]([CH3:2])([CH3:3])[O:4][c:5]1[c:6]([NH:18][c:19]2[n:20][cH:21][c:22]([CH3:38])[c:23]([NH:25][c:26]3[c:27]([S:32](=[O:33])(=[O:34])[CH:35]([CH3:36])[CH3:37])[cH:28][cH:29][cH:30][cH:31]3)[n:24]2)[cH:7][c:8]([C:12]#[CH:13])[c:9]([CH3:11])[cH:10]1Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-10d9397532c7450f99dd106f2f6240e7
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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