Dichloromethane → HCID 75096569, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([c:7]1[cH:8][cH:9][c:10]([NH:13][C:14](=[O:15])[CH:16]2[NH:17][CH:18]([CH2:39][C:40]([CH3:41])([CH3:42])[CH3:43])[C:19]([C:29]#[N:30])([c:31]3[c:32]([F:38])[cH:33][c:34]([Cl:37])[cH:35][cH:36]3)[CH:20]2[c:21]2[c:22]([F:28])[c:23]([Cl:27])[cH:24][cH:25][cH:26]2)[cH:11][cH:12]1)=[O:44].[CH2:52]([Cl:53])[Cl:54].[F:45][C:46]([F:47])([F:48])[C:49]([OH:50])=[O:51]>>[O:5]=[C:6]([c:7]1[cH:8][cH:9][c:10]([NH:13][C:14](=[O:15])[CH:16]2[NH:17][CH:18]([CH2:39][C:40]([CH3:41])([CH3:42])[CH3:43])[C:19]([C:29]#[N:30])([c:31]3[c:32]([F:38])[cH:33][c:34]([Cl:37])[cH:35][cH:36]3)[CH:20]2[c:21]2[c:22]([F:28])[c:23]([Cl:27])[cH:24][cH:25][cH:26]2)[cH:11][cH:12]1)[OH:44]Participants
4
Sources & evidence
- ORD record
- ord-d3224f7570dc4a37b0da26098a2b7a80
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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