Methanol → 4-[2-[4-[3-(2,5-Difluorophenyl)prop-2-enylamino]piperidin-1-yl]ethyl]-3-oxo-1,4-benzoxazine-6-carbonitrile
Reaction equation
[C:35]([BH3-:36])#[N:37].[CH3:39][OH:40].[Cl:41][CH2:42][Cl:43].[F:23][c:24]1[c:25]([CH:31]=[CH:32][CH:33]=[O:34])[cH:26][c:27]([F:30])[cH:28][cH:29]1.[NH2:1][CH:2]1[CH2:3][CH2:4][N:5]([CH2:8][CH2:9][N:10]2[C:11](=[O:22])[CH2:12][O:13][c:14]3[c:15]2[cH:16][c:17]([C:20]#[N:21])[cH:18][cH:19]3)[CH2:6][CH2:7]1.[Na+:38]>>[NH:1]([CH:2]1[CH2:3][CH2:4][N:5]([CH2:8][CH2:9][N:10]2[C:11](=[O:22])[CH2:12][O:13][c:14]3[c:15]2[cH:16][c:17]([C:20]#[N:21])[cH:18][cH:19]3)[CH2:6][CH2:7]1)[CH2:33][CH:32]=[CH:31][c:25]1[c:24]([F:23])[cH:29][cH:28][c:27]([F:30])[cH:26]1Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-703fe4dce59c4bae82108bfc64114d3d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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