3,4-Xylenethiol → 6-[4-(3,4-Dimethyl-phenylmercapto)-butoxy]-4,4-dimethyl-4H-3,1-benzoxazin-2-one
Reaction equation
[CH3:20][c:21]1[cH:22][c:23]([SH:28])[cH:24][cH:25][c:26]1[CH3:27].[Cl:1][CH2:2][CH2:3][CH2:4][CH2:5][O:6][c:7]1[cH:8][cH:9][c:10]2[c:11]([cH:19]1)[C:12]([CH3:17])([CH3:18])[O:13][C:14](=[O:16])[NH:15]2>>[CH2:2]([CH2:3][CH2:4][CH2:5][O:6][c:7]1[cH:8][cH:9][c:10]2[c:11]([cH:19]1)[C:12]([CH3:17])([CH3:18])[O:13][C:14](=[O:16])[NH:15]2)[S:28][c:23]1[cH:22][c:21]([CH3:20])[c:26]([CH3:27])[cH:25][cH:24]1Participants
3
Sources & evidence
- ORD record
- ord-dab4f301314947e0a00577b59802c2be
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
Loading…