Toluene → HCID 59279542, compound
Reaction equation
[CH3:1][Al:2]([CH3:3])[CH3:4].[CH3:36][c:37]1[cH:38][cH:39][cH:40][cH:41][cH:42]1.[NH2:5][c:6]1[n:7][cH:8][c:9]([C:10]#[N:11])[cH:12][cH:13]1.[OH:14][CH:15]([C:16](=[O:17])[O:18][CH3:19])[CH2:20][O:21][CH:22]([CH2:23][O:24][Si:25]([CH:26]([CH3:27])[CH3:28])([CH:29]([CH3:30])[CH3:31])[CH:32]([CH3:33])[CH3:34])[CH3:35]>>[NH:5]([c:6]1[n:7][cH:8][c:9]([C:10]#[N:11])[cH:12][cH:13]1)[C:16]([CH:15]([OH:14])[CH2:20][O:21][CH:22]([CH2:23][O:24][Si:25]([CH:26]([CH3:27])[CH3:28])([CH:29]([CH3:30])[CH3:31])[CH:32]([CH3:33])[CH3:34])[CH3:35])=[O:17]Participants
5
Sources & evidence
- ORD record
- ord-afb6af7793a04389bb64454166eb0fad
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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