HCID 67882088, compound → HCID 178425941, compound
Reaction equation
[C:25](#[N:26])[NH:27][C:28]([O:29][c:30]1[cH:31][cH:32][cH:33][cH:34][cH:35]1)=[N:36][CH2:37][CH2:38][S:39][CH2:40][c:41]1[n:42][c:43]([NH:46][C:47](=[NH:48])[NH2:49])[s:44][cH:45]1.[CH3:1][N:2]([CH2:3][CH2:4][CH2:5][CH2:6][NH2:7])[CH2:8][CH2:9][S:10][CH:11]([c:12]1[cH:13][cH:14][cH:15][cH:16][cH:17]1)[c:18]1[cH:19][cH:20][c:21]([CH3:24])[cH:22][cH:23]1>>[CH3:1][N:2]([CH2:3][CH2:4][CH2:5][CH2:6][N:7]=[C:28]([NH:27][C:25]#[N:26])[NH:36][CH2:37][CH2:38][S:39][CH2:40][c:41]1[n:42][c:43]([NH:46][C:47](=[NH:48])[NH2:49])[s:44][cH:45]1)[CH2:8][CH2:9][S:10][CH:11]([c:12]1[cH:13][cH:14][cH:15][cH:16][cH:17]1)[c:18]1[cH:19][cH:20][c:21]([CH3:24])[cH:22][cH:23]1Participants
3
Sources & evidence
- ORD record
- ord-8f39f7b7c6694b2aa2052bff507f3fd5
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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