Acetic Acid → [4-(6-{[(1H-imidazol-2-ylmethyl)-(1-methyl-1H-imidazol-2-ylmethyl)-amino]-methyl}-1-propyl-1H-benzimidazol-2-yl)-butyl]-dipropyl-amine
Reaction equation
[C:44]([BH3-:45])#[N:46].[CH3:32][C:33](=[O:34])[OH:35].[CH3:36][n:37]1[c:38]([CH:42]=[O:43])[n:39][cH:40][cH:41]1.[CH3:48][OH:49].[Na+:47].[nH:1]1[c:2]([CH2:6][NH:7][CH2:8][c:9]2[cH:10][cH:11][c:12]3[c:13]([n:14]([CH2:28][CH2:29][CH3:30])[c:15]([CH2:17][CH2:18][CH2:19][CH2:20][N:21]([CH2:22][CH2:23][CH3:24])[CH2:25][CH2:26][CH3:27])[n:16]3)[cH:31]2)[n:3][cH:4][cH:5]1>>[n:1]1[c:2]([CH2:6][N:7]([CH2:8][c:9]2[cH:10][cH:11][c:12]3[c:13]([n:14]([CH2:28][CH2:29][CH3:30])[c:15]([CH2:17][CH2:18][CH2:19][CH2:20][N:21]([CH2:22][CH2:23][CH3:24])[CH2:25][CH2:26][CH3:27])[n:16]3)[cH:31]2)[CH2:42][c:38]2[n:37]([CH3:36])[cH:41][cH:40][n:39]2)[nH:3][cH:4][cH:5]1Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-78bcfca7bd27426aa22eeb5d8e003f4d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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