3,4-Dichlorobenzenethiol → 6-[4-(3,4-dichloro-phenylmercapto)-butoxy]-4,4-dimethyl-4H-3,1-benzoxazin-2-one
Reaction equation
[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.[Cl:20][c:21]1[cH:22][c:23]([SH:28])[cH:24][cH:25][c:26]1[Cl:27]>>[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]([Cl:20])[c:26]([Cl:27])[cH:25][cH:24]1Participants
3
Sources & evidence
- ORD record
- ord-331d756f9610492f8f8c127f9358300e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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