Ethanol → 1,3-benzothiazol-2-yl(2-{[2-(1H-imidazol-4-yl)ethyl]amino}-4-pyrimidinyl)acetonitrile
Reaction equation
[CH3:20][CH2:21][N:22]([CH2:23][CH3:24])[CH2:25][CH3:26].[CH3:35][CH2:36][OH:37].[NH2:27][CH2:28][CH2:29][c:30]1[cH:31][nH:32][cH:33][n:34]1.[s:1]1[c:2]([CH:10]([C:11]#[N:12])[c:13]2[n:14][c:15]([Cl:19])[n:16][cH:17][cH:18]2)[n:3][c:4]2[c:5]1[cH:6][cH:7][cH:8][cH:9]2>>[s:1]1[c:2]([CH:10]([C:11]#[N:12])[c:13]2[n:14][c:15]([NH:27][CH2:28][CH2:29][c:30]3[cH:31][nH:32][cH:33][n:34]3)[n:16][cH:17][cH:18]2)[n:3][c:4]2[c:5]1[cH:6][cH:7][cH:8][cH:9]2Participants
5
Sources & evidence
- ORD record
- ord-f1814e8979954fbd80e728408bd6c2e9
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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