Toluene → 2-(2-Chloroethyl)-2,3-dihydro-4-methylnaphth[2,3-f][1,4]oxazepine-5(4H)-thione
Reaction equation
[CH3:35][c:36]1[cH:37][cH:38][cH:39][cH:40][cH:41]1.[Cl:1][CH2:2][CH2:3][CH:4]1[O:5][c:6]2[c:7]([cH:13][c:14]3[cH:15][cH:16][cH:17][cH:18][c:19]3[cH:20]2)[C:8](=[O:12])[N:9]([CH3:11])[CH2:10]1.[P:21]12(=[S:22])[S:23][P:24]3(=[S:34])[S:25][P:26](=[S:32])([S:27][P:28](=[S:31])([S:29]3)[S:30]1)[S:33]2>>[Cl:1][CH2:2][CH2:3][CH:4]1[O:5][c:6]2[c:7]([cH:13][c:14]3[cH:15][cH:16][cH:17][cH:18][c:19]3[cH:20]2)[C:8](=[S:22])[N:9]([CH3:11])[CH2:10]1Participants
4
Sources & evidence
- ORD record
- ord-14c19c18a819458db442efe02b7eb3bf
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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