HCID 21088274, compound → HCID 178457058, compound
Reaction equation
[Cl:29][c:30]1[c:31]2[c:32]([n:33][c:34]([C:36]([F:37])([F:38])[F:39])[n:35]1)[n:40][cH:41][c:42]([Cl:44])[cH:43]2.[NH2:1][CH:2]1[C:3](=[O:28])[N:4]([CH:7]2[CH:8]([CH2:18][S:19](=[O:20])(=[O:21])[c:22]3[cH:23][cH:24][cH:25][cH:26][cH:27]3)[CH2:9][CH:10]([N:13]([CH3:14])[CH:15]([CH3:16])[CH3:17])[CH2:11][CH2:12]2)[CH2:5][CH2:6]1>>[NH:1]([CH:2]1[C:3](=[O:28])[N:4]([CH:7]2[CH:8]([CH2:18][S:19](=[O:20])(=[O:21])[c:22]3[cH:23][cH:24][cH:25][cH:26][cH:27]3)[CH2:9][CH:10]([N:13]([CH3:14])[CH:15]([CH3:16])[CH3:17])[CH2:11][CH2:12]2)[CH2:5][CH2:6]1)[c:30]1[c:31]2[c:32]([n:33][c:34]([C:36]([F:37])([F:38])[F:39])[n:35]1)[n:40][cH:41][c:42]([Cl:44])[cH:43]2Participants
3
Sources & evidence
- ORD record
- ord-b0c57c85502d400991f7415ad6fe2bab
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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