Ethyl isocyanate → 1-(5-Benzyloxy-7-bromo-benzothiazol-2-yl)-3-ethyl-urea
Reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][c:11]([Br:19])[c:12]2[c:13]([n:14][c:15]([NH2:17])[s:16]2)[cH:18]1.[CH2:20]([CH3:21])[N:22]=[C:23]=[O:24].[O:25]1[CH2:26][CH2:27][O:28][CH2:29][CH2:30]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][c:11]([Br:19])[c:12]2[c:13]([n:14][c:15]([NH:17][C:23]([NH:22][CH2:20][CH3:21])=[O:24])[s:16]2)[cH:18]1Participants
4
Sources & evidence
- ORD record
- ord-a5edff7d1a0b48dcb7da6eb559086dd3
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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