1-Butanol → N4-(5-Isopropyl-1H-pyrazol-3-yl)-N6-[2-(4-methylpiperazin-1-yl)ethyl]-N2-(3-phenylisoxazol-5-ylmethyl)-pyrimidine-2,4,6-triamine
Reaction equation
[CH2:40]([OH:41])[CH2:42][CH2:43][CH3:44].[CH3:30][N:31]1[CH2:32][CH2:33][N:34]([CH2:37][CH2:38][NH2:39])[CH2:35][CH2:36]1.[CH3:45][OH:46].[Cl:1][c:2]1[cH:3][c:4]([NH:21][c:22]2[n:23][nH:24][c:25]([CH:27]([CH3:28])[CH3:29])[cH:26]2)[n:5][c:6]([NH:8][CH2:9][c:10]2[cH:11][c:12](-[c:15]3[cH:16][cH:17][cH:18][cH:19][cH:20]3)[n:13][o:14]2)[n:7]1>>[c:2]1([NH:39][CH2:38][CH2:37][N:34]2[CH2:33][CH2:32][N:31]([CH3:30])[CH2:36][CH2:35]2)[cH:3][c:4]([NH:21][c:22]2[n:23][nH:24][c:25]([CH:27]([CH3:28])[CH3:29])[cH:26]2)[n:5][c:6]([NH:8][CH2:9][c:10]2[cH:11][c:12](-[c:15]3[cH:16][cH:17][cH:18][cH:19][cH:20]3)[n:13][o:14]2)[n:7]1Participants
5
Reactant 4
Product 1
Sources & evidence
- ORD record
- ord-3ad796080bf94dab9e59e098ee17f9e2
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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