Benzene → HCID 15008560, compound
Reaction equation
[CH3:1][C:2]([CH3:3])=[CH:4][CH3:5].[CH3:20][C:21]#[N:22].[cH:23]1[cH:24][cH:25][cH:26][cH:27][cH:28]1.[n:6]1([CH2:11][C:12](=[O:13])[c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)[n:7][cH:8][n:9][cH:10]1>>[CH3:1][C:2]1([CH3:3])[CH:4]([CH3:5])[O:13][C:12]1([CH2:11][n:6]1[n:7][cH:8][n:9][cH:10]1)[c:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1Participants
5
Sources & evidence
- ORD record
- ord-bb3fba42a05d4dc89223d4e59d66091d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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