Benzene → HCID 44243040, compound
Reaction equation
[CH2:15]([CH3:16])[NH:17][C:18]([NH:19][c:20]1[c:21]([C:29](=[O:30])[N:31]2[CH2:32][CH2:33][C:34]3([C:35](=[O:46])[NH:36][C:37]([CH2:39][CH2:40][C:41]([O:43][CH2:42][CH3:44])=[O:45])=[N:38]3)[CH2:47][CH2:48]2)[c:22]2[c:23]([s:24]1)[cH:25][cH:26][cH:27][cH:28]2)=[O:49].[CH2:56]1[O:57][CH2:58][CH2:59][CH2:60]1.[CH2:7]([CH3:8])[N:9]([CH2:10][CH3:11])[Al:12]([CH3:13])[CH3:14].[CH3:1][CH2:2][CH2:3][CH2:4][CH2:5][CH3:6].[cH:50]1[cH:51][cH:52][cH:53][cH:54][cH:55]1>>[CH2:7]([CH3:8])[N:9]([CH2:10][CH3:11])[C:41]([CH2:40][CH2:39][C:37]1=[N:38][C:34]2([CH2:33][CH2:32][N:31]([C:29]([c:21]3[c:20]([NH:19][C:18]([NH:17][CH2:15][CH3:16])=[O:49])[s:24][c:23]4[c:22]3[cH:28][cH:27][cH:26][cH:25]4)=[O:30])[CH2:48][CH2:47]2)[C:35](=[O:46])[NH:36]1)=[O:43]Participants
6
Sources & evidence
- ORD record
- ord-4f82119657e24f57bb1948ee092fe54d
- Source dataset
- Test data from https://doi.org/10.1039/C8SC04228D
Reaction notes
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