Acetone → 2,6-Diethyl-4-nitrophenylthiourea
Reaction equation
[C:5]([Cl:6])(=[O:7])[c:8]1[cH:9][cH:10][cH:11][cH:12][cH:13]1.[CH2:14]([CH3:15])[c:16]1[c:17]([NH2:18])[c:19]([CH2:26][CH3:27])[cH:20][c:21]([N+:23](=[O:24])[O-:25])[cH:22]1.[CH3:30][C:31](=[O:32])[CH3:33].[CH3:35][CH2:36][OH:37].[K+:1].[Na+:29].[OH-:28].[OH2:34].[S-:2][C:3]#[N:4]>>[S:2]=[C:3]([NH2:4])[NH:18][c:17]1[c:16]([CH2:14][CH3:15])[cH:22][c:21]([N+:23](=[O:24])[O-:25])[cH:20][c:19]1[CH2:26][CH3:27]Participants
10
Sources & evidence
- ORD record
- ord-098cc92f45d94dc8a37f1f4dfa2a6324
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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