tert-Butyl isocyanate → HCID 10602350, compound
Reaction equation
[C:33]([CH3:34])([CH3:35])([CH3:36])[N:37]=[C:38]=[O:39].[CH3:1][N:2]1[CH2:3][CH2:4][N:5]([CH2:8][CH2:9][CH2:10][NH:11][c:12]2[n:13][cH:14][c:15]3[c:16]([n:17]2)[n:18][c:19]([NH2:32])[c:20](-[c:22]2[c:23]([CH3:31])[c:24]([CH3:30])[cH:25][c:26]([CH3:29])[c:27]2[CH3:28])[cH:21]3)[CH2:6][CH2:7]1>>[CH3:1][N:2]1[CH2:3][CH2:4][N:5]([CH2:8][CH2:9][CH2:10][NH:11][c:12]2[n:13][cH:14][c:15]3[c:16]([n:17]2)[n:18][c:19]([NH:32][C:38]([NH:37][C:33]([CH3:34])([CH3:35])[CH3:36])=[O:39])[c:20](-[c:22]2[c:23]([CH3:31])[c:24]([CH3:30])[cH:25][c:26]([CH3:29])[c:27]2[CH3:28])[cH:21]3)[CH2:6][CH2:7]1Participants
3
Sources & evidence
- ORD record
- ord-bd799723c2384c6788c666b3787b7751
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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