Water → HCID 44223427, compound
Reaction equation
[CH3:30][CH2:31][N:32]=[C:33]=[N:34][CH2:35][CH2:36][CH2:37][N:38]([CH3:39])[CH3:40].[F:1][c:2]1[c:3]([C:4](=[O:5])[OH:6])[c:7]([F:18])[cH:8][cH:9][c:10]1[NH:11][S:12](=[O:13])(=[O:14])[CH2:15][CH2:16][CH3:17].[O:56]=[CH:57][N:58]([CH3:59])[CH3:60].[OH2:29].[OH:19][n:20]1[c:21]2[c:22]([cH:23][cH:24][cH:25][cH:26]2)[n:27][n:28]1.[n:41]1(-[c:46]2[n:47][nH:48][c:49]3[n:50][cH:51][c:52]([NH2:55])[cH:53][c:54]23)[cH:42][n:43][cH:44][cH:45]1>>[F:1][c:2]1[c:3]([C:4](=[O:6])[NH:55][c:52]2[cH:51][n:50][c:49]3[nH:48][n:47][c:46](-[n:41]4[cH:42][n:43][cH:44][cH:45]4)[c:54]3[cH:53]2)[c:7]([F:18])[cH:8][cH:9][c:10]1[NH:11][S:12](=[O:13])(=[O:14])[CH2:15][CH2:16][CH3:17]Participants
7
Sources & evidence
- ORD record
- ord-a2e6f8b808514cdaa5b41e5baa42f430
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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