2-Bromophenyl isocyanate → HCID 53843945, compound
Reaction equation
[Br:22][c:23]1[c:24]([N:29]=[C:30]=[O:31])[cH:25][cH:26][cH:27][cH:28]1.[n:1]1[cH:2][cH:3][cH:4][c:5]2[cH:6][cH:7][cH:8][c:9]([S:11](=[O:12])(=[O:13])[NH:14][c:15]3[c:16]([NH2:17])[cH:18][cH:19][cH:20][cH:21]3)[c:10]12>>[n:1]1[cH:2][cH:3][cH:4][c:5]2[cH:6][cH:7][cH:8][c:9]([S:11](=[O:12])(=[O:13])[NH:14][c:15]3[c:16]([NH:17][C:30]([NH:29][c:24]4[c:23]([Br:22])[cH:28][cH:27][cH:26][cH:25]4)=[O:31])[cH:18][cH:19][cH:20][cH:21]3)[c:10]12Participants
3
Sources & evidence
- ORD record
- ord-2918554cf82941038560a4fb32059a39
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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