HCID 23080636, compound → HCID 10251652, compound
Reaction equation
[C:1]([O:2][C:3](=[O:4])[NH:8][c:9]1[n:10][cH:11][cH:12][c:13](-[c:15]2[c:16](-[c:29]3[cH:30][c:31]([C:35]([F:36])([F:37])[F:38])[cH:32][cH:33][cH:34]3)[n:17][n:18](-[c:20]3[cH:21][cH:22][c:23]4[n:24]([n:25]3)[cH:26][n:27][n:28]4)[cH:19]2)[cH:14]1)([CH3:5])([CH3:6])[CH3:7].[C:39]([O:40][C:41]([NH:42][c:43]1[cH:44][c:45](-[c:46]2[c:47](-[c:48]3[cH:49][cH:50][cH:51][cH:52][cH:53]3)[n:54][n:55](-[c:56]3[cH:57][cH:58][c:59]4[n:60]([cH:61][n:62][n:63]4)[n:64]3)[cH:65]2)[cH:66][cH:67][n:68]1)=[O:69])([CH3:70])([CH3:71])[CH3:72]>>[NH2:8][c:9]1[n:10][cH:11][cH:12][c:13](-[c:15]2[c:16](-[c:29]3[cH:30][c:31]([C:35]([F:36])([F:37])[F:38])[cH:32][cH:33][cH:34]3)[n:17][n:18](-[c:20]3[cH:21][cH:22][c:23]4[n:24]([n:25]3)[cH:26][n:27][n:28]4)[cH:19]2)[cH:14]1Participants
3
Sources & evidence
- ORD record
- ord-5d0528d5757244f596c8ef129dc35ae9
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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