Acetonitrile → Ethyl 3-[4-[4-(trifluoromethyl)anilino]-7-[3-(trifluoromethyl)pyridin-2-yl]quinazolin-2-yl]propanoate
Reaction equation
[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][CH2:6][c:7]1[n:8][c:9]2[cH:10][c:11](-[c:18]3[n:19][cH:20][cH:21][cH:22][c:23]3[C:24]([F:25])([F:26])[F:27])[cH:12][cH:13][c:14]2[c:15]([Cl:17])[n:16]1)=[O:28].[CH3:40][C:41]#[N:42].[F:29][C:30]([c:31]1[cH:32][cH:33][c:34]([NH2:35])[cH:36][cH:37]1)([F:38])[F:39]>>[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][CH2:6][c:7]1[n:8][c:9]2[cH:10][c:11](-[c:18]3[n:19][cH:20][cH:21][cH:22][c:23]3[C:24]([F:25])([F:26])[F:27])[cH:12][cH:13][c:14]2[c:15]([NH:35][c:34]2[cH:33][cH:32][c:31]([C:30]([F:29])([F:38])[F:39])[cH:37][cH:36]2)[n:16]1)=[O:28]Participants
4
Sources & evidence
- ORD record
- ord-03ad45cc36704c45b55442d1c49fe7a0
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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