Acetate → 2-(4-{4-[4-(3-Methanesulfonyl-propoxy)-indol-1-yl]-pyrimidin-2-ylamino}-cyclohexyl)-propan-2-ol
Reaction equation
[C:27]([O-:28])(=[O:29])[CH3:30].[CH3:1][S:2](=[O:3])[c:4]1[n:5][cH:6][cH:7][c:8](-[n:10]2[cH:11][cH:12][c:13]3[c:14]([O:19][CH2:20][CH2:21][CH2:22][S:23](=[O:24])(=[O:25])[CH3:26])[cH:15][cH:16][cH:17][c:18]23)[n:9]1.[CH3:51][N:52]1[CH2:53][CH2:54][CH2:55][C:56]1=[O:57].[CH:42]([N:43]([CH2:44][CH3:45])[CH:46]([CH3:47])[CH3:48])([CH3:49])[CH3:50].[OH:31][C:32]([CH3:33])([CH3:34])[CH:35]1[CH2:36][CH2:37][CH:38]([NH3+:41])[CH2:39][CH2:40]1>>[c:4]1([NH:41][CH:38]2[CH2:37][CH2:36][CH:35]([C:32]([OH:31])([CH3:33])[CH3:34])[CH2:40][CH2:39]2)[n:5][cH:6][cH:7][c:8](-[n:10]2[cH:11][cH:12][c:13]3[c:14]([O:19][CH2:20][CH2:21][CH2:22][S:23](=[O:24])(=[O:25])[CH3:26])[cH:15][cH:16][cH:17][c:18]23)[n:9]1Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-012c8b9c30464fbf86f77534d59a221b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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