Acetonitrile → HCID 46199028, compound
Reaction equation
[CH3:33][S:34]([OH:35])(=[O:36])=[O:37].[CH3:58][C:59]#[N:60].[CH:24]([N:25]([CH2:26][CH3:27])[CH:28]([CH3:29])[CH3:30])([CH3:31])[CH3:32].[Cl:1][C:2](=[O:3])[O:4][c:5]1[cH:6][cH:7][c:8]([N+:9]([O-:10])=[O:11])[cH:12][cH:13]1.[NH2:14][CH:15]1[CH2:16][CH2:17][CH:18]([C:21](=[O:22])[NH2:23])[CH2:19][CH2:20]1.[NH2:38][CH2:39][c:40]1[cH:41][c:42]2[c:46]([cH:47][cH:48]1)[C:45](=[O:49])[N:44]([CH:50]1[C:51](=[O:57])[NH:52][C:53](=[O:56])[CH2:54][CH2:55]1)[CH2:43]2>>[C:2](=[O:3])([NH:14][CH:15]1[CH2:16][CH2:17][CH:18]([C:21](=[O:22])[NH2:23])[CH2:19][CH2:20]1)[NH:38][CH2:39][c:40]1[cH:41][c:42]2[c:46]([cH:47][cH:48]1)[C:45](=[O:49])[N:44]([CH:50]1[C:51](=[O:57])[NH:52][C:53](=[O:56])[CH2:54][CH2:55]1)[CH2:43]2Participants
7
Sources & evidence
- ORD record
- ord-f7cc4690785f4258a36e7a4cb88ae347
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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