Toluene → HCID 14757118, compound
Reaction equation
[CH3:29][CH2:30][CH2:31][CH2:32][SnH:33]([CH2:34][CH2:35][CH2:36][CH3:37])[CH2:38][CH2:39][CH2:40][CH3:41].[CH3:54][c:55]1[cH:56][cH:57][cH:58][cH:59][cH:60]1.[N:42]#[C:43][C:44]([N:45]=[N:46][C:47]([C:48]#[N:49])([CH3:50])[CH3:51])([CH3:52])[CH3:53].[n:1]1([C:2]([O:3][CH:9]2[CH:10]([CH2:19][O:20][C:21]([c:22]3[cH:23][cH:24][cH:25][cH:26][cH:27]3)=[O:28])[O:11][CH:12]3[O:13][C:14]([CH3:17])([CH3:18])[O:15][CH:16]23)=[S:4])[cH:5][cH:6][n:7][cH:8]1>>[CH2:9]1[CH:10]([CH2:19][O:20][C:21]([c:22]2[cH:23][cH:24][cH:25][cH:26][cH:27]2)=[O:28])[O:11][CH:12]2[O:13][C:14]([CH3:17])([CH3:18])[O:15][CH:16]12Participants
5
Sources & evidence
- ORD record
- ord-dc9c2266fac842c398af7a1ae884424f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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