Tetrahydrofuran → HCID 178452682, compound
Reaction equation
[CH2:86]1[O:87][CH2:88][CH2:89][CH2:90]1.[N+:36](=[O:37])([O-:38])[c:39]1[cH:40][cH:41][c:42]([S:45](=[O:46])(=[O:47])[NH:48][c:49]2[cH:50][n:51][cH:52][cH:53][cH:54]2)[cH:43][cH:44]1.[O:74]=[C:75]([O:76][CH2:77][CH3:78])[N:79]=[N:80][C:81]([O:82][CH2:83][CH3:84])=[O:85].[OH:1][CH:2]1[CH2:3][N:4]([CH2:7][c:8]2[cH:9][cH:10][c:11]([C:12](=[O:13])[NH:14][c:15]3[c:16]([NH:26][C:27]([O:28][C:29]([CH3:30])([CH3:31])[CH3:32])=[O:33])[cH:17][cH:18][c:19](-[c:21]4[s:22][cH:23][cH:24][cH:25]4)[cH:20]3)[cH:34][cH:35]2)[CH2:5][CH2:6]1.[c:55]1([P:56]([c:57]2[cH:58][cH:59][cH:60][cH:61][cH:62]2)[c:63]2[cH:64][cH:65][cH:66][cH:67][cH:68]2)[cH:69][cH:70][cH:71][cH:72][cH:73]1>>[CH:2]1([N:48]([S:45]([c:42]2[cH:41][cH:40][c:39]([N+:36](=[O:37])[O-:38])[cH:44][cH:43]2)(=[O:46])=[O:47])[c:49]2[cH:50][n:51][cH:52][cH:53][cH:54]2)[CH2:3][N:4]([CH2:7][c:8]2[cH:9][cH:10][c:11]([C:12](=[O:13])[NH:14][c:15]3[c:16]([NH:26][C:27]([O:28][C:29]([CH3:30])([CH3:31])[CH3:32])=[O:33])[cH:17][cH:18][c:19](-[c:21]4[s:22][cH:23][cH:24][cH:25]4)[cH:20]3)[cH:34][cH:35]2)[CH2:5][CH2:6]1Participants
6
Sources & evidence
- ORD record
- ord-6b8509a93b3e47dc92ec1f5440c2a2e4
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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