4-Methylbenzenethiol → 6-[4-(4-Methyl-phenylmercapto)-butoxy]-4H-3,1-benzoxazin-2-one
Reaction equation
[CH3:18][c:19]1[cH:20][cH:21][c:22]([SH:25])[cH:23][cH:24]1.[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:17]1)[CH2:12][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:17]1)[CH2:12][O:13][C:14](=[O:16])[NH:15]2)[S:25][c:22]1[cH:21][cH:20][c:19]([CH3:18])[cH:24][cH:23]1Participants
3
Sources & evidence
- ORD record
- ord-26079625a2044e468cea6428b049486a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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