Butyl isocyanate → HCID 11293868, compound

HRID 2323798Notes

Reaction equation

HRID 2323798 reaction equation
[CH2:1]([CH2:2][CH2:3][CH3:4])[N:5]=[C:6]=[O:7].[NH2:8][c:9]1[cH:10][cH:11][c:12]([N:15]2[CH2:16][CH2:17][N:18]([C:21](=[O:22])[c:23]3[c:24]([C:29]([F:30])([F:31])[F:32])[cH:25][cH:26][cH:27][cH:28]3)[CH2:19][CH2:20]2)[n:13][n:14]1>>[CH2:1]([CH2:2][CH2:3][CH3:4])[NH:5][C:6](=[O:7])[NH:8][c:9]1[cH:10][cH:11][c:12]([N:15]2[CH2:16][CH2:17][N:18]([C:21](=[O:22])[c:23]3[c:24]([C:29]([F:30])([F:31])[F:32])[cH:25][cH:26][cH:27][cH:28]3)[CH2:19][CH2:20]2)[n:13][n:14]1

Participants

3

Reactant 2

HCID 8110Butyl isocyanateHCID 66849536[4-(6-Aminopyridazin-3-yl)piperazin-1-yl](2-trifluoromethylphenyl)methanone

Product 1

HCID 11293868HCID 11293868, compound

Sources & evidence

ORD record
ord-69168fdea69241a4a45f90ecb4982ea1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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