tert-butyl N-(4-aminobutyl)carbamate → HCID 86595104, compound
Reaction equation
[C:10]([CH3:11])([CH3:12])([CH3:13])[O:14][C:15](=[O:16])[NH:17][CH2:18][CH2:19][CH2:20][CH2:21][NH2:22].[CH2:23]([CH3:24])[O:25][C:26](=[O:27])[c:28]1[cH:29][c:30]([NH:34][c:35]2[n:36][cH:37][cH:38][c:39](-[c:41]3[c:42]([C:47]([F:48])([F:49])[F:50])[n:43][c:44]([Cl:46])[s:45]3)[n:40]2)[cH:31][cH:32][cH:33]1.[CH3:51][C:52]#[N:53].[CH:1]([N:2]([CH:3]([CH3:4])[CH3:5])[CH2:6][CH3:7])([CH3:8])[CH3:9]>>[C:10]([CH3:11])([CH3:12])([CH3:13])[O:14][C:15](=[O:16])[NH:17][CH2:18][CH2:19][CH2:20][CH2:21][NH:22][c:44]1[n:43][c:42]([C:47]([F:48])([F:49])[F:50])[c:41](-[c:39]2[cH:38][cH:37][n:36][c:35]([NH:34][c:30]3[cH:29][c:28]([C:26]([O:25][CH2:23][CH3:24])=[O:27])[cH:33][cH:32][cH:31]3)[n:40]2)[s:45]1Participants
5
Sources & evidence
- ORD record
- ord-43907ac5dbdb4a19a66375dc87fbcd59
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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