Chloride → HCID 178484613, compound
Reaction equation
[B-:51]([F:52])([F:53])([F:54])[F:55].[C:1](=[O:2])([OH:3])[CH2:4][N:5]([S:6](=[O:7])(=[O:8])[CH3:9])[c:10]1[cH:11][cH:12][c:13]([NH:16][C:17]([c:18]2[cH:19][cH:20][cH:21][cH:22][cH:23]2)=[C:24]2[C:25](=[O:36])[NH:26][c:27]3[cH:28][cH:29][c:30]([N+:33](=[O:34])[O-:35])[cH:31][c:32]32)[cH:14][cH:15]1.[CH2:73]([N:74]([CH:75]([CH3:76])[CH3:77])[CH:78]([CH3:79])[CH3:80])[CH3:81].[CH3:38][NH2+:39][CH3:40].[Cl-:37].[O:82]=[CH:83][N:84]([CH3:85])[CH3:86].[OH:41][n:42]1[c:43]2[c:44]([cH:45][cH:46][cH:47][cH:48]2)[n:49][n:50]1.[n:56]1([O:57][C:58]([N:59]([CH3:60])[CH3:61])=[N+:62]([CH3:63])[CH3:64])[c:65]2[cH:66][cH:67][cH:68][cH:69][c:70]2[n:71][n:72]1>>[C:1](=[O:3])([CH2:4][N:5]([S:6](=[O:7])(=[O:8])[CH3:9])[c:10]1[cH:11][cH:12][c:13]([NH:16][C:17]([c:18]2[cH:19][cH:20][cH:21][cH:22][cH:23]2)=[C:24]2[C:25](=[O:36])[NH:26][c:27]3[cH:28][cH:29][c:30]([N+:33](=[O:34])[O-:35])[cH:31][c:32]32)[cH:14][cH:15]1)[N:39]([CH3:38])[CH3:40]Participants
9
Reactant 8
Product 1
Sources & evidence
- ORD record
- ord-e146088e585a4d10a2c8434dfa0a2625
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
Loading…