Ethyl 3-isocyanatopropanoate → HCID 11340881, compound

HRID 1135615Notes

Reaction equation

HRID 1135615 reaction equation
[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][CH2:6][N:7]=[C:8]=[O:9])=[O:10].[NH2:11][c:12]1[cH:13][cH:14][c:15]([N:18]2[CH2:19][CH2:20][N:21]([C:24](=[O:25])[c:26]3[c:27]([C:32]([F:33])([F:34])[F:35])[cH:28][cH:29][cH:30][cH:31]3)[CH2:22][CH2:23]2)[n:16][n:17]1>>[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][CH2:6][NH:7][C:8](=[O:9])[NH:11][c:12]1[cH:13][cH:14][c:15]([N:18]2[CH2:19][CH2:20][N:21]([C:24](=[O:25])[c:26]3[c:27]([C:32]([F:33])([F:34])[F:35])[cH:28][cH:29][cH:30][cH:31]3)[CH2:22][CH2:23]2)[n:16][n:17]1)=[O:10]

Participants

3

Reactant 2

HCID 2733373Ethyl 3-isocyanatopropanoateHCID 66849536[4-(6-Aminopyridazin-3-yl)piperazin-1-yl](2-trifluoromethylphenyl)methanone

Product 1

HCID 11340881HCID 11340881, compound

Sources & evidence

ORD record
ord-739f0f7e777e4a51b2c27158f3069171
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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