N-methyl-2-pyrrolidone → 4-(8-(4-Methoxyphenyl)-3-oxo-2-((6-(trifluoromethyl)pyridin-3-yl)methyl)-2,3-dihydro-[1,2,4]triazolo[4,3-a]pyridin-7-yl)benzonitrile

HRID 2147722Notes

Reaction equation

HRID 2147722 reaction equation
[CH3:40][N:41]1[C:42](=[O:43])[CH2:44][CH2:45][CH2:46]1.[Cl:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[c:9](-[c:29]3[cH:30][cH:31][c:32]([O:35][CH3:36])[cH:33][cH:34]3)[c:10]3[n:11]([cH:12][cH:13]2)[c:14](=[O:28])[n:15]([CH2:17][c:18]2[cH:19][n:20][c:21]([C:24]([F:25])([F:26])[F:27])[cH:22][cH:23]2)[n:16]3)[cH:6][cH:7]1.[Cu:37][C:38]#[N:39]>>[c:2]1([C:38]#[N:39])[cH:3][cH:4][c:5](-[c:8]2[c:9](-[c:29]3[cH:30][cH:31][c:32]([O:35][CH3:36])[cH:33][cH:34]3)[c:10]3[n:11]([cH:12][cH:13]2)[c:14](=[O:28])[n:15]([CH2:17][c:18]2[cH:19][n:20][c:21]([C:24]([F:25])([F:26])[F:27])[cH:22][cH:23]2)[n:16]3)[cH:6][cH:7]1

Participants

4

Reactant 3

HCID 13387N-methyl-2-pyrrolidoneHCID 160049417-(4-chlorophenyl)-8-(4-methoxyphenyl)-2-((6-(trifluoromethyl)pyridin-3-yl)methyl)-[1,2,4]triazolo[4,3-a]pyridin-3(2H)-oneHCID 178418546HCID 178418546, compound

Product 1

HCID 160049424-(8-(4-Methoxyphenyl)-3-oxo-2-((6-(trifluoromethyl)pyridin-3-yl)methyl)-2,3-dihydro-[1,2,4]triazolo[4,3-a]pyridin-7-yl)benzonitrile

Sources & evidence

ORD record
ord-5880ff9ca43c4f6a9961fbae67ae4d6e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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