Thiophenol → 7-(4-Phenylmercapto-butoxy)-4,4-dimethyl-4H-3,1-benzoxazin-2-one
Reaction equation
[CH3:1][S:2]([O:3][CH2:6][CH2:7][CH2:8][CH2:9][O:10][c:11]1[cH:12][c:13]2[c:14]([cH:22][cH:23]1)[C:15]([CH3:20])([CH3:21])[O:16][C:17](=[O:19])[NH:18]2)(=[O:4])=[O:5].[SH:24][c:25]1[cH:26][cH:27][cH:28][cH:29][cH:30]1>>[CH2:6]([CH2:7][CH2:8][CH2:9][O:10][c:11]1[cH:12][c:13]2[c:14]([cH:22][cH:23]1)[C:15]([CH3:20])([CH3:21])[O:16][C:17](=[O:19])[NH:18]2)[S:24][c:25]1[cH:26][cH:27][cH:28][cH:29][cH:30]1Participants
3
Sources & evidence
- ORD record
- ord-5e809f2e4d6148c3afb53fe663915cba
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
Loading…