Toluene → HCID 68902439, compound
Reaction equation
[CH3:46][c:47]1[cH:48][cH:49][cH:50][cH:51][cH:52]1.[CH:28]([c:29]1[cH:30][cH:31][cH:32][cH:33][cH:34]1)([c:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1)[N:41]1[CH2:42][CH:43]([OH:45])[CH2:44]1.[Cl:1][c:2]1[c:3]([CH:4]([c:5]2[cH:6][cH:7][c:8]([Cl:11])[cH:9][cH:10]2)[OH:12])[cH:13][cH:14][cH:15][cH:16]1.[c:17]1([CH3:18])[cH:19][cH:20][c:21]([S:22]([OH:23])(=[O:24])=[O:25])[cH:26][cH:27]1>>[Cl:1][c:2]1[c:3]([CH:4]([c:5]2[cH:6][cH:7][c:8]([Cl:11])[cH:9][cH:10]2)[O:12][CH:43]2[CH2:42][N:41]([CH:28]([c:29]3[cH:30][cH:31][cH:32][cH:33][cH:34]3)[c:35]3[cH:36][cH:37][cH:38][cH:39][cH:40]3)[CH2:44]2)[cH:13][cH:14][cH:15][cH:16]1Participants
5
Sources & evidence
- ORD record
- ord-effae0c829b1409385d3231d959daee6
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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