Dimethylacetamide → HCID 178521189, compound
Reaction equation
[C:1]([n:2]1[cH:3][cH:4][n:5][cH:6]1)([n:7]1[cH:8][cH:9][n:10][cH:11]1)=[O:12].[CH3:72][N:73]([CH3:74])[C:75](=[O:76])[CH3:77].[Cl:13][c:14]1[cH:15][c:16]([S:21][CH2:22][C:23](=[O:24])[OH:25])[cH:17][cH:18][c:19]1[Cl:20].[F:26][C:27]([F:28])([F:29])[C:30]([O-:31])=[O:32].[NH2:33][CH:34]1[CH:35]2[S:36][CH2:37][C:38]([CH:46]=[C:47]3[C:48](=[O:71])[N:49]([CH2:52][c:53]4[cH:54][cH:55][n+:56]([CH2:59][C:60]([NH:61][c:62]5[cH:63][c:64]([F:69])[c:65]([OH:68])[cH:66][cH:67]5)=[O:70])[cH:57][cH:58]4)[CH2:50][CH2:51]3)=[C:39]([C:43](=[O:44])[OH:45])[N:40]2[C:41]1=[O:42]>>[Cl:13][c:14]1[cH:15][c:16]([S:21][CH2:22][C:23](=[O:25])[NH:33][CH:34]2[CH:35]3[S:36][CH2:37][C:38]([CH:46]=[C:47]4[C:48](=[O:71])[N:49]([CH2:52][c:53]5[cH:54][cH:55][n+:56]([CH2:59][C:60]([NH:61][c:62]6[cH:63][c:64]([F:69])[c:65]([OH:68])[cH:66][cH:67]6)=[O:70])[cH:57][cH:58]5)[CH2:50][CH2:51]4)=[C:39]([C:43](=[O:44])[O-:45])[N:40]3[C:41]2=[O:42])[cH:17][cH:18][c:19]1[Cl:20]Participants
6
Sources & evidence
- ORD record
- ord-1206dcb25d614d788855e25cc0c0463e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
Loading…