(2-Isocyanatocyclopropyl)benzene → 1-[2-[2-(4-Amino-2,6,7-trimethylimidazo[4,5-c]pyridin-1-yl)ethoxy]ethyl]-3-(2-phenylcyclopropyl)urea

HRID 203997

Reaction equation

HRID 203997 reaction equation
[NH2:13][CH2:14][CH2:15][O:16][CH2:17][CH2:18][n:19]1[c:20]([CH3:31])[n:21][c:22]2[c:23]([NH2:30])[n:24][c:25]([CH3:29])[c:26]([CH3:28])[c:27]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][O:16][CH2:17][CH2:18][n:19]3[c:20]([CH3:31])[n:21][c:22]4[c:23]([NH2:30])[n:24][c:25]([CH3:29])[c:26]([CH3:28])[c:27]34)[CH2:9]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

3

Reactant 2

HCID 582709(2-Isocyanatocyclopropyl)benzeneHCID 219130531-[2-(2-aminoethoxy)ethyl]-2,6,7-trimethyl-1H-imidazo[4,5-c]pyridin-4-amine

Product 1

HCID 219140541-[2-[2-(4-Amino-2,6,7-trimethylimidazo[4,5-c]pyridin-1-yl)ethoxy]ethyl]-3-(2-phenylcyclopropyl)urea

Sources & evidence

ORD record
ord-90719a49dbb249598e538d9a926aa90d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Linked notes

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