Diisopropylethylamine → HCID 68556627, compound
Reaction equation
[CH:40]([N:41]([CH2:42][CH3:43])[CH:44]([CH3:45])[CH3:46])([CH3:47])[CH3:48].[F:19][c:20]1[cH:21][cH:22][c:23]([CH:26]([N:27]2[CH2:28][CH2:29][NH:30][CH2:31][CH2:32]2)[c:33]2[cH:34][cH:35][c:36]([F:39])[cH:37][cH:38]2)[cH:24][cH:25]1.[c:1]1(-[n:7]2[n:8][c:9]([CH2:15][CH2:16][CH:17]=[O:18])[cH:10][c:11]2[CH2:12][CH2:13][CH3:14])[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1(-[n:7]2[n:8][c:9]([CH2:15][CH2:16][CH2:17][N:30]3[CH2:29][CH2:28][N:27]([CH:26]([c:23]4[cH:22][cH:21][c:20]([F:19])[cH:25][cH:24]4)[c:33]4[cH:34][cH:35][c:36]([F:39])[cH:37][cH:38]4)[CH2:32][CH2:31]3)[cH:10][c:11]2[CH2:12][CH2:13][CH3:14])[cH:2][cH:3][cH:4][cH:5][cH:6]1Participants
4
Sources & evidence
- ORD record
- ord-d532753b1aee4137ba509a3d472aa52d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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