Water → HCID 74065058, compound
Reaction equation
[CH3:57][CH2:58][O:59][C:60]([CH3:61])=[O:62].[NH2:1][C:2]([C:3]([CH3:4])([O:5][c:6]1[cH:7][c:8]([C:13]([CH2:14][c:15]2[cH:16][cH:17][cH:18][cH:19][cH:20]2)([c:21]2[cH:22][c:23]([F:31])[cH:24][c:25]([C:27]([F:28])([F:29])[F:30])[cH:26]2)[NH:32][C:33]([c:34]2[cH:35][c:36]([C:40]([F:41])([F:42])[F:43])[cH:37][cH:38][cH:39]2)=[O:44])[cH:9][cH:10][c:11]1[F:12])[CH3:45])=[O:46].[O:51]=[CH:52][N:53]([CH3:54])[CH3:55].[OH2:56].[S:47]([Cl:48])([Cl:49])=[O:50]>>[N:1]#[C:2][C:3]([CH3:4])([O:5][c:6]1[cH:7][c:8]([C:13]([CH2:14][c:15]2[cH:16][cH:17][cH:18][cH:19][cH:20]2)([c:21]2[cH:22][c:23]([F:31])[cH:24][c:25]([C:27]([F:28])([F:29])[F:30])[cH:26]2)[NH:32][C:33]([c:34]2[cH:35][c:36]([C:40]([F:41])([F:42])[F:43])[cH:37][cH:38][cH:39]2)=[O:44])[cH:9][cH:10][c:11]1[F:12])[CH3:45]Participants
6
Sources & evidence
- ORD record
- ord-6ae4eac979d9410583ce7eb1a6da6920
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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