HCID 68514321, compound → HCID 178509912, compound
Reaction equation
[Cl:1][c:2]1[cH:3][c:4]([C:5]#[N:6])[cH:7][c:8]([O:10][c:11]2[c:12]([Cl:29])[c:13](=[O:28])[nH:14][c:15]([CH2:17][CH2:18][c:19]3[n:20][nH:21][c:22]4[n:23][cH:24][cH:25][cH:26][c:27]34)[cH:16]2)[cH:9]1.[Cl:30][c:31]1[c:32]([O:33][c:34]2[cH:35][c:36]([C:37]#[N:38])[cH:39][c:40]([Cl:41])[cH:42]2)[cH:43][c:44]([CH:45]=[CH:46][c:47]2[c:48]3[c:49]([n:50][cH:51][cH:52][cH:53]3)[n:54]([C:55]([O:56][C:57]([CH3:58])([CH3:59])[CH3:60])=[O:61])[n:62]2)[n:63][c:64]1[O:65][CH3:66]>>[Cl:1][c:2]1[cH:3][c:4]([C:5]#[N:6])[cH:7][c:8]([O:10][c:11]2[cH:12][c:13](=[O:28])[nH:14][c:15]([CH2:17][CH2:18][c:19]3[n:20][nH:21][c:22]4[n:23][cH:24][cH:25][cH:26][c:27]34)[cH:16]2)[cH:9]1Participants
3
Sources & evidence
- ORD record
- ord-be142d9ec1ea4c019d38bf3743491b34
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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