Acetic Acid → 2-[(5-phenethyl-pyridine-3-carbonyl)-amino]-1H-benzoimidazole-4-carboxylic acid (1H-imidazol-2-yl)-amide
Reaction equation
[CH3:35][OH:36].[CH3:37][C:38](=[O:39])[OH:40].[nH:1]1[c:2]([NH:6][C:7](=[O:8])[c:9]2[cH:10][cH:11][cH:12][c:13]3[nH:14][c:15]([NH:18][C:19](=[O:20])[c:21]4[cH:22][n:23][cH:24][c:25]([C:27]#[C:28][c:29]5[cH:30][cH:31][cH:32][cH:33][cH:34]5)[cH:26]4)[n:16][c:17]23)[n:3][cH:4][cH:5]1>>[n:1]1[c:2]([NH:6][C:7](=[O:8])[c:9]2[cH:10][cH:11][cH:12][c:13]3[nH:14][c:15]([NH:18][C:19](=[O:20])[c:21]4[cH:22][n:23][cH:24][c:25]([CH2:27][CH2:28][c:29]5[cH:30][cH:31][cH:32][cH:33][cH:34]5)[cH:26]4)[n:16][c:17]23)[nH:3][cH:4][cH:5]1Participants
4
Sources & evidence
- ORD record
- ord-6a67d351183a46d2a3ecda91bd417ab4
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
Loading…