O-Xylene → HCID 22503313, compound
Reaction equation
[Br:34][c:35]1[n:36][c:37]([N:45]2[CH2:46][CH2:47][N:48]([CH2:51][CH3:52])[CH2:49][CH2:50]2)[c:38]2[cH:39][cH:40][cH:41][cH:42][c:43]2[cH:44]1.[CH2:1]([Sn:2]([CH2:3][CH2:4][CH2:5][CH3:26])([c:6]1[cH:7][cH:8][c:9]([S:12](=[O:13])(=[O:14])[CH2:15][CH2:16][CH2:17][O:18][CH2:19][c:20]2[cH:21][cH:22][cH:23][cH:24][cH:25]2)[cH:10][cH:11]1)[CH2:27][CH2:28][CH2:29][CH3:30])[CH2:31][CH2:32][CH3:33].[CH3:61][CH2:62][O:63][C:64](=[O:65])[CH3:66].[c:53]1([CH3:54])[c:55]([CH3:56])[cH:57][cH:58][cH:59][cH:60]1>>[c:6]1(-[c:35]2[n:36][c:37]([N:45]3[CH2:46][CH2:47][N:48]([CH2:51][CH3:52])[CH2:49][CH2:50]3)[c:38]3[cH:39][cH:40][cH:41][cH:42][c:43]3[cH:44]2)[cH:7][cH:8][c:9]([S:12](=[O:13])(=[O:14])[CH2:15][CH2:16][CH2:17][O:18][CH2:19][c:20]2[cH:21][cH:22][cH:23][cH:24][cH:25]2)[cH:10][cH:11]1Participants
5
Sources & evidence
- ORD record
- ord-859ef59a71574dd19d3e9c8a1b19074a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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