Acetic Acid → 4-{[bis(1H-imidazol-2-ylmethyl)-amino]-methyl}-N-(4-cyclohexylamino-butyl)-benzamide
Reaction equation
[C:36]([BH3-:37])#[N:38].[CH3:40][C:41](=[O:42])[OH:43].[CH3:44][OH:45].[Na+:39].[O:29]=[C:30]1[CH2:31][CH2:32][CH2:33][CH2:34][CH2:35]1.[nH:1]1[c:2]([CH2:6][N:7]([CH2:8][c:9]2[nH:10][cH:11][cH:12][n:13]2)[CH2:14][c:15]2[cH:16][cH:17][c:18]([C:19](=[O:20])[NH:21][CH2:22][CH2:23][CH2:24][CH2:25][NH2:26])[cH:27][cH:28]2)[n:3][cH:4][cH:5]1>>[nH:1]1[c:2]([CH2:6][N:7]([CH2:8][c:9]2[n:10][cH:11][cH:12][nH:13]2)[CH2:14][c:15]2[cH:16][cH:17][c:18]([C:19](=[O:20])[NH:21][CH2:22][CH2:23][CH2:24][CH2:25][NH:26][CH:30]3[CH2:31][CH2:32][CH2:33][CH2:34][CH2:35]3)[cH:27][cH:28]2)[n:3][cH:4][cH:5]1Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-aafb16136d744e67a9a08be3f5a4a129
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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