4-((4-Ethylpiperazin-1-yl)methyl)-3-(trifluoromethyl)aniline → HCID 11993677, compound
Reaction equation
[CH2:21]([CH3:22])[N:23]1[CH2:24][CH2:25][N:26]([CH2:29][c:30]2[c:31]([C:37]([F:38])([F:39])[F:40])[cH:32][c:33]([NH2:36])[cH:34][cH:35]2)[CH2:27][CH2:28]1.[Cl:1][c:2]1[c:3]([CH2:17][C:18](=[O:19])[OH:20])[cH:4][cH:5][c:6](-[n:8]2[cH:9][n:10][c:11]3[c:12]2[n:13][cH:14][cH:15][cH:16]3)[cH:7]1>>[Cl:1][c:2]1[c:3]([CH2:17][C:18](=[O:20])[NH:36][c:33]2[cH:32][c:31]([C:37]([F:38])([F:39])[F:40])[c:30]([CH2:29][N:26]3[CH2:25][CH2:24][N:23]([CH2:21][CH3:22])[CH2:28][CH2:27]3)[cH:35][cH:34]2)[cH:4][cH:5][c:6](-[n:8]2[cH:9][n:10][c:11]3[c:12]2[n:13][cH:14][cH:15][cH:16]3)[cH:7]1Participants
3
Sources & evidence
- ORD record
- ord-f071e1b5881243c2bf31902638e43050
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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