Acetonitrile → HCID 57917641, compound
Reaction equation
[CH2:25]([N:26]([CH:27]([CH3:28])[CH3:29])[CH:30]([CH3:31])[CH3:32])[CH3:33].[CH3:48][C:49]#[N:50].[Cl:34][CH2:35][c:36]1[cH:37][c:38]([C:39](=[O:40])[O:41][CH3:42])[cH:43][cH:44][c:45]1[O:46][CH3:47].[c:1]1([NH:7][C:8](=[O:9])[NH:10][c:11]2[cH:12][cH:13][c:14]([C:17](=[O:18])[N:19]3[CH2:20][CH2:21][NH:22][CH2:23][CH2:24]3)[cH:15][cH:16]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([NH:7][C:8](=[O:9])[NH:10][c:11]2[cH:12][cH:13][c:14]([C:17](=[O:18])[N:19]3[CH2:20][CH2:21][N:22]([CH2:35][c:36]4[cH:37][c:38]([C:39](=[O:40])[O:41][CH3:42])[cH:43][cH:44][c:45]4[O:46][CH3:47])[CH2:23][CH2:24]3)[cH:15][cH:16]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1Participants
5
Sources & evidence
- ORD record
- ord-8001da3d08504a0f8ca531d8eaf8f1ac
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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