4-Methylphenyl isocyanate → Ethyl 2-ethoxy-3-[4-[3-[methyl-[(4-methylphenyl)carbamoyl]amino]phenyl]phenyl]prop-2-enoate
Reaction equation
[CH2:1]([CH3:2])[O:3][C:4]([C:5](=[O:6])[O:7][CH2:8][CH3:9])=[CH:10][c:11]1[cH:12][cH:13][c:14](-[c:17]2[cH:18][c:19]([NH:23][CH3:24])[cH:20][cH:21][cH:22]2)[cH:15][cH:16]1.[CH3:25][c:26]1[cH:27][cH:28][c:29]([N:32]=[C:33]=[O:34])[cH:30][cH:31]1>>[CH2:1]([CH3:2])[O:3][C:4]([C:5](=[O:6])[O:7][CH2:8][CH3:9])=[CH:10][c:11]1[cH:12][cH:13][c:14](-[c:17]2[cH:18][c:19]([N:23]([CH3:24])[C:33]([NH:32][c:29]3[cH:28][cH:27][c:26]([CH3:25])[cH:31][cH:30]3)=[O:34])[cH:20][cH:21][cH:22]2)[cH:15][cH:16]1Participants
3
Sources & evidence
- ORD record
- ord-d90e2667217d48a19382330a1ad815f5
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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