Hydrochloric Acid → HCID 66736072, compound
Reaction equation
[CH2:53]([N:54]=[C:55]=[N:56][CH2:57][CH2:58][CH2:59][N:60]([CH3:61])[CH3:62])[CH3:63].[Cl:85][CH2:86][Cl:87].[ClH:52].[F:1][c:2]1[cH:3][c:4]([S:9](=[O:10])(=[O:11])[c:12]2[cH:13][c:14]3[c:15]([NH:40][C:41]([c:42]4[cH:43][cH:44][c:45]([C:46](=[O:47])[OH:48])[cH:49][cH:50]4)=[O:51])[n:16][n:17]([C:21]([c:22]4[cH:23][cH:24][cH:25][cH:26][cH:27]4)([c:28]4[cH:29][cH:30][cH:31][cH:32][cH:33]4)[c:34]4[cH:35][cH:36][cH:37][cH:38][cH:39]4)[c:18]3[cH:19][cH:20]2)[cH:5][c:6]([F:8])[cH:7]1.[N:74]1([CH:79]2[CH2:80][CH2:81][NH:82][CH2:83][CH2:84]2)[CH2:75][CH2:76][CH2:77][CH2:78]1.[OH:64][n:65]1[c:66]2[cH:67][cH:68][cH:69][cH:70][c:71]2[n:72][n:73]1>>[F:1][c:2]1[cH:3][c:4]([S:9](=[O:10])(=[O:11])[c:12]2[cH:13][c:14]3[c:15]([NH:40][C:41]([c:42]4[cH:43][cH:44][c:45]([C:46](=[O:47])[N:82]5[CH2:81][CH2:80][CH:79]([N:74]6[CH2:75][CH2:76][CH2:77][CH2:78]6)[CH2:84][CH2:83]5)[cH:49][cH:50]4)=[O:51])[n:16][n:17]([C:21]([c:22]4[cH:23][cH:24][cH:25][cH:26][cH:27]4)([c:28]4[cH:29][cH:30][cH:31][cH:32][cH:33]4)[c:34]4[cH:35][cH:36][cH:37][cH:38][cH:39]4)[c:18]3[cH:19][cH:20]2)[cH:5][c:6]([F:8])[cH:7]1Participants
7
Sources & evidence
- ORD record
- ord-5db0157fb15f4f62ba6746dee34be9ea
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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