Benzene → HCID 70273828, compound
Reaction equation
[CH2:1]([C:2]1([CH2:3][CH3:4])[CH:6]([S:7][CH3:8])[N:5]([CH2:9][C:10]([O:11][CH3:12])=[O:13])[C:14]1=[O:15])[CH3:16].[CH3:59][O-:60].[F:17][CH:18]([CH2:19][CH2:20][CH2:21][CH:22]([C:23](=[O:24])[OH:25])[N:26]1[C:27](=[O:36])[C:28]([CH2:32][CH3:33])([CH2:34][CH3:35])[CH:29]1[S:30][CH3:31])[CH2:37][CH2:38][c:39]1[cH:40][cH:41][cH:42][cH:43][cH:44]1.[F:45][c:46]1[cH:47][cH:48][c:49]([CH2:50][CH2:51][CH2:52][CH2:53][CH2:54][CH2:55][OH:56])[cH:57][cH:58]1.[Na+:61].[cH:62]1[cH:63][cH:64][cH:65][cH:66][cH:67]1>>[NH2:5][C:23]([CH:22]([CH2:21][CH2:20][CH2:19][CH:18]([F:17])[CH2:37][CH2:38][c:39]1[cH:40][cH:41][cH:42][cH:43][cH:44]1)[N:26]1[C:27](=[O:36])[C:28]([CH2:32][CH3:33])([CH2:34][CH3:35])[CH:29]1[S:30][CH3:31])=[O:24]Participants
7
Sources & evidence
- ORD record
- ord-67310ac14a3f46268b95308deeaeadc6
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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