Benzene → N-isopropyl-N-(3,4-methylenedioxyphenyl)thiourea
Reaction equation
[CH:10]([CH3:11])([CH3:12])[N:13]([C:14](=[S:15])[NH:16][C:17](=[O:18])[c:19]1[cH:20][cH:21][cH:22][cH:23][cH:24]1)[c:25]1[cH:26][c:27]2[c:28]([cH:29][cH:30]1)[O:31][CH2:32][O:33]2.[Na+:9].[O:1]1[CH2:2][CH2:3][O:4][CH2:5][CH2:6]1.[OH-:8].[OH2:7].[cH:34]1[cH:35][cH:36][cH:37][cH:38][cH:39]1>>[CH:10]([CH3:11])([CH3:12])[N:13]([C:14](=[S:15])[NH2:16])[c:25]1[cH:26][c:27]2[c:28]([cH:29][cH:30]1)[O:31][CH2:32][O:33]2Participants
7
Sources & evidence
- ORD record
- ord-40335b004fb343d0a999c0367d282245
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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