Ethyl isocyanate → HCID 11710863, compound
Reaction equation
[CH2:25]([CH3:26])[N:27]=[C:28]=[O:29].[CH3:1][N:2]1[CH:3]2[CH2:4][N:5]([c:10]3[cH:11][cH:12][c:13]([C:16]#[C:17][c:18]4[cH:19][cH:20][c:21]([NH2:24])[cH:22][cH:23]4)[n:14][n:15]3)[CH2:6][CH:7]1[CH2:8][CH2:9]2>>[CH3:1][N:2]1[CH:3]2[CH2:4][N:5]([c:10]3[cH:11][cH:12][c:13]([C:16]#[C:17][c:18]4[cH:19][cH:20][c:21]([NH:24][C:28]([NH:27][CH2:25][CH3:26])=[O:29])[cH:22][cH:23]4)[n:14][n:15]3)[CH2:6][CH:7]1[CH2:8][CH2:9]2Participants
3
Sources & evidence
- ORD record
- ord-52651f85244640a5b04446c050620c1d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
Loading…