Acetonitrile → 3-(2,3-Dichloro-4-hydroxyphenyl)-1-(5-(4-(trifluoromethyl)phenyl)thien-2-yl)prop-2-en-1-one

HRID 215295

Reaction equation

HRID 215295 reaction equation
[CH3:30][C:31]#[N:32].[Cl:19][c:20]1[c:21]([CH:22]=[O:23])[cH:24][cH:25][c:26]([OH:29])[c:27]1[Cl:28].[F:1][C:2]([c:3]1[cH:4][cH:5][c:6](-[c:9]2[cH:10][cH:11][c:12]([C:14]([CH3:15])=[O:16])[s:13]2)[cH:7][cH:8]1)([F:17])[F:18]>>[F:1][C:2]([c:3]1[cH:4][cH:5][c:6](-[c:9]2[cH:10][cH:11][c:12]([C:14]([CH:15]=[CH:22][c:21]3[c:20]([Cl:19])[c:27]([Cl:28])[c:26]([OH:29])[cH:25][cH:24]3)=[O:16])[s:13]2)[cH:7][cH:8]1)([F:17])[F:18]

Participants

4

Reactant 3

HCID 6342AcetonitrileHCID 5283802,3-Dichloro-4-hydroxybenzaldehydeHCID 41914941-(5-(4-(Trifluoromethyl)phenyl)thiophen-2-yl)ethan-1-one

Product 1

HCID 666244623-(2,3-Dichloro-4-hydroxyphenyl)-1-(5-(4-(trifluoromethyl)phenyl)thien-2-yl)prop-2-en-1-one

Sources & evidence

ORD record
ord-6ed515b159e24dccac2753d385fcb6ab
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Linked notes

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