Diethyl Ether → HCID 20465905, compound
Reaction equation
[CH3:33][CH2:34][O:35][CH2:36][CH3:37].[CH:1]([CH3:2])([CH3:3])[O:4][C:5](=[O:6])[c:7]1[cH:8][cH:9][c:10]([N:13]=[C:14]=[O:15])[cH:11][cH:12]1.[Cl:16][c:17]1[cH:18][cH:19][c:20]([C:23]2=[N:24][NH:25][CH2:26][CH:27]2[CH2:28][CH2:29][CH2:30][C:31]#[N:32])[cH:21][cH:22]1>>[CH:1]([CH3:2])([CH3:3])[O:4][C:5](=[O:6])[c:7]1[cH:8][cH:9][c:10]([NH:13][C:14](=[O:15])[N:25]2[N:24]=[C:23]([c:20]3[cH:19][cH:18][c:17]([Cl:16])[cH:22][cH:21]3)[CH:27]([CH2:28][CH2:29][CH2:30][C:31]#[N:32])[CH2:26]2)[cH:11][cH:12]1Participants
4
Sources & evidence
- ORD record
- ord-aea360db890747af80e1e480fa738296
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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