Toluene → HCID 18444815, compound
Reaction equation
[CH2:14]([CH3:15])[NH:16][c:17]1[n:18][c:19]([S:25][CH3:26])[n:20][cH:21][c:22]1[CH:23]=[O:24].[CH3:42][c:43]1[cH:44][cH:45][cH:46][cH:47][cH:48]1.[F:1][c:2]1[c:3]([NH2:13])[c:4]([F:12])[c:5]([O:10][CH3:11])[cH:6][c:7]1[O:8][CH3:9].[O:27]=[S:28](=[O:29])([OH:30])[CH2:31][C:32]12[CH2:33][CH2:34][CH:35]([C:36]1([CH3:37])[CH3:38])[CH2:39][C:40]2=[O:41]>>[F:1][c:2]1[c:3]([N:13]=[CH:23][c:22]2[c:17]([NH:16][CH2:14][CH3:15])[n:18][c:19]([S:25][CH3:26])[n:20][cH:21]2)[c:4]([F:12])[c:5]([O:10][CH3:11])[cH:6][c:7]1[O:8][CH3:9]Participants
5
Sources & evidence
- ORD record
- ord-279ea850150c46e39bdb967104324b7a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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