4-Cyclohexylbenzene-1-thiol → 6-[4-(4-Cyclohexyl-phenylmercapto)-butoxy]-4H-3,1-benzoxazin-2-one
Reaction equation
[CH:18]1([c:24]2[cH:25][cH:26][c:27]([SH:30])[cH:28][cH:29]2)[CH2:19][CH2:20][CH2:21][CH2:22][CH2:23]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:30][c:27]1[cH:26][cH:25][c:24]([CH:18]2[CH2:19][CH2:20][CH2:21][CH2:22][CH2:23]2)[cH:29][cH:28]1Participants
3
Sources & evidence
- ORD record
- ord-ba52eadcf0954ef48f39dd9e0630f450
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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