Benzene → HCID 21539297, compound
Reaction equation
[CH2:1]1[CH2:2][CH2:3][CH2:4][CH2:5][C:6]12[NH:7][C:8]1([CH2:9][CH2:10][CH2:11][CH2:12][CH2:13]1)[NH:14][C:15]2=[S:16].[CH3:17][N:18]=[C:19]=[O:20].[N:21]12[CH2:22][CH2:23][N:24]([CH2:25][CH2:26]1)[CH2:27][CH2:28]2.[cH:29]1[cH:30][cH:31][cH:32][cH:33][cH:34]1>>[CH2:1]1[CH2:2][CH2:3][CH2:4][CH2:5][C:6]12[NH:7][C:8]1([CH2:9][CH2:10][CH2:11][CH2:12][CH2:13]1)[N:14]([C:19]([NH:18][CH3:17])=[O:20])[C:15]2=[S:16]Participants
5
Sources & evidence
- ORD record
- ord-682104504ba34006b8b28b508a4d19c2
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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