Ethyl isocyanate → HCID 44481435, compound
Reaction equation
[CH2:29]([CH3:30])[N:31]=[C:32]=[O:33].[CH3:1][C:2]1([c:23]2[cH:24][cH:25][cH:26][cH:27][cH:28]2)[CH2:3][CH2:4][N:5]2[c:6]3[c:7]([cH:8][c:9]([NH2:12])[cH:10][c:11]31)[C:13]([c:16]1[cH:17][cH:18][cH:19][cH:20][cH:21]1)([CH3:22])[CH2:14][CH2:15]2>>[CH3:1][C:2]1([c:23]2[cH:24][cH:25][cH:26][cH:27][cH:28]2)[CH2:3][CH2:4][N:5]2[c:6]3[c:7]([cH:8][c:9]([NH:12][C:32]([NH:31][CH2:29][CH3:30])=[O:33])[cH:10][c:11]31)[C:13]([c:16]1[cH:17][cH:18][cH:19][cH:20][cH:21]1)([CH3:22])[CH2:14][CH2:15]2Participants
3
Sources & evidence
- ORD record
- ord-213278e506f04d589c768b0a4f9e037f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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