Acetonitrile → HCID 58866201, compound

HRID 680186Notes

Reaction equation

HRID 680186 reaction equation
[CH3:30][CH2:31][N:32]([CH2:33][CH3:34])[CH2:35][CH3:36].[CH3:37][C:38]#[N:39].[Cl:1][c:2]1[cH:3][cH:4][c:5](-[n:8]2[n:9][cH:10][c:11]([C:17](=[O:18])[Cl:19])[c:12]2[C:13]([F:14])([F:15])[F:16])[cH:6][cH:7]1.[F:20][c:21]1[cH:22][c:23]([CH2:27][CH2:28][NH2:29])[cH:24][cH:25][cH:26]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5](-[n:8]2[n:9][cH:10][c:11]([C:17](=[O:18])[NH:29][CH2:28][CH2:27][c:23]3[cH:22][c:21]([F:20])[cH:26][cH:25][cH:24]3)[c:12]2[C:13]([F:14])([F:15])[F:16])[cH:6][cH:7]1

Participants

5

Reactant 4

HCID 6342AcetonitrileHCID 8471TriethylamineHCID 5339282-(3-Fluorophenyl)ethanamineHCID 27366451-(4-Chlorophenyl)-5-(trifluoromethyl)-1H-pyrazole-4-carbonyl chloride

Product 1

HCID 58866201HCID 58866201, compound

Sources & evidence

ORD record
ord-21c9f91adcad4aa59bb5769a141dd491
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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