4-Cyclohexylbenzene-1-thiol → 6-[3-(4-Cyclohexyl-phenylmercapto)-propoxy]-4,4-dimethyl-4H-3,1-benzoxazin-2-one
Reaction equation
[CH:19]1([c:25]2[cH:26][cH:27][c:28]([SH:31])[cH:29][cH:30]2)[CH2:20][CH2:21][CH2:22][CH2:23][CH2:24]1.[Cl:1][CH2:2][CH2:3][CH2:4][O:5][c:6]1[cH:7][cH:8][c:9]2[c:10]([cH:18]1)[C:11]([CH3:16])([CH3:17])[O:12][C:13](=[O:15])[NH:14]2>>[CH2:2]([CH2:3][CH2:4][O:5][c:6]1[cH:7][cH:8][c:9]2[c:10]([cH:18]1)[C:11]([CH3:16])([CH3:17])[O:12][C:13](=[O:15])[NH:14]2)[S:31][c:28]1[cH:27][cH:26][c:25]([CH:19]2[CH2:20][CH2:21][CH2:22][CH2:23][CH2:24]2)[cH:30][cH:29]1Participants
3
Sources & evidence
- ORD record
- ord-5f3237caca3548b79d06346343e6bc48
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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