(2-Isocyanatocyclopropyl)benzene → 1-[4-[4-Amino-2-(ethoxymethyl)-7-methylimidazo[4,5-c]pyridin-1-yl]butyl]-3-(2-phenylcyclopropyl)urea

HRID 312959

Reaction equation

HRID 312959 reaction equation
[NH2:13][CH2:14][CH2:15][CH2:16][CH2:17][n:18]1[c:19]([CH2:29][O:30][CH2:31][CH3:32])[n:20][c:21]2[c:22]([NH2:28])[n:23][cH:24][c:25]([CH3:27])[c:26]12.[c:1]1([CH:7]2[CH:8]([N:10]=[C:11]=[O:12])[CH2:9]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([CH:7]2[CH:8]([NH:10][C:11](=[O:12])[NH:13][CH2:14][CH2:15][CH2:16][CH2:17][n:18]3[c:19]([CH2:29][O:30][CH2:31][CH3:32])[n:20][c:21]4[c:22]([NH2:28])[n:23][cH:24][c:25]([CH3:27])[c:26]34)[CH2:9]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

3

Reactant 2

HCID 582709(2-Isocyanatocyclopropyl)benzeneHCID 219460261-(4-aminobutyl)-2-(ethoxymethyl)-7-methyl-1H-imidazo[4,5-c]pyridin-4-amine

Product 1

HCID 223973741-[4-[4-Amino-2-(ethoxymethyl)-7-methylimidazo[4,5-c]pyridin-1-yl]butyl]-3-(2-phenylcyclopropyl)urea

Sources & evidence

ORD record
ord-8b95d24978444619b1665175cbd27912
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Linked notes

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