Toluene → HCID 18940669, compound
Reaction equation
[CH3:15][c:16]1[cH:17][cH:18][cH:19][cH:20][cH:21]1.[CH3:22][O:23][c:24]1[c:25]([N:31]2[CH2:32][CH2:33][N:34]([CH3:37])[CH2:35][CH2:36]2)[cH:26][c:27]([NH2:30])[cH:28][cH:29]1.[CH3:41][CH2:42][N:43]([CH2:44][CH3:45])[CH2:46][CH3:47].[Cl:38][CH2:39][Cl:40].[OH:1][C:2](=[O:3])[c:4]1[cH:5][cH:6][c:7]([Cl:8])[cH:9][cH:10]1.[S:11]([Cl:12])([Cl:13])=[O:14]>>[C:2](=[O:3])([c:4]1[cH:5][cH:6][c:7]([Cl:8])[cH:9][cH:10]1)[NH:30][c:27]1[cH:26][c:25]([N:31]2[CH2:32][CH2:33][N:34]([CH3:37])[CH2:35][CH2:36]2)[c:24]([O:23][CH3:22])[cH:29][cH:28]1Participants
7
Sources & evidence
- ORD record
- ord-bb00af926f0f4b6881f54ef24a5169dc
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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