Ethanol → {4-[(1H-benzoimidazol-2-ylmethyl)-(3-methyl-pyridin-2-ylmethyl)-amino]-butyl}-carbamic acid tert-butyl ester

HRID 2336029Notes

Reaction equation

HRID 2336029 reaction equation
[C:1]([O:2][C:3](=[O:4])[n:8]1[c:9]([CH2:17][N:18]([CH2:19][c:20]2[n:21][cH:22][cH:23][cH:24][c:25]2[CH3:26])[CH2:27][CH2:28][CH2:29][CH2:30][NH:31][C:32](=[O:33])[O:34][C:35]([CH3:36])([CH3:37])[CH3:38])[n:10][c:11]2[c:12]1[cH:13][cH:14][cH:15][cH:16]2)([CH3:5])([CH3:6])[CH3:7].[CH3:41][CH2:42][OH:43].[NH2:39][NH2:40]>>[n:8]1[c:9]([CH2:17][N:18]([CH2:19][c:20]2[n:21][cH:22][cH:23][cH:24][c:25]2[CH3:26])[CH2:27][CH2:28][CH2:29][CH2:30][NH:31][C:32](=[O:33])[O:34][C:35]([CH3:36])([CH3:37])[CH3:38])[nH:10][c:11]2[c:12]1[cH:13][cH:14][cH:15][cH:16]2

Participants

4

Reactant 3

HCID 702EthanolHCID 9321HydrazineHCID 672726372-{[(4-tert-Butoxycarbonylamino-butyl)-(3-methyl-pyridin-2-ylmethyl)-amino]-methyl}-benzoimidazole-1-carboxylic acid tert-butyl ester

Product 1

HCID 67271501{4-[(1H-benzoimidazol-2-ylmethyl)-(3-methyl-pyridin-2-ylmethyl)-amino]-butyl}-carbamic acid tert-butyl ester

Sources & evidence

ORD record
ord-c77b3b21d60f406f9ec9b10055d78479
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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