Oxalyl chloride → 5-Cyano-furan-2-carboxylic acid [5-(4-methyl-piperazin-1-yl)-2-piperidin-1-yl-phenyl]-amide

HRID 1141275Notes

Reaction equation

HRID 1141275 reaction equation
[C:23](#[N:24])[c:25]1[cH:26][cH:27][c:28]([C:30](=[O:31])[OH:32])[o:29]1.[CH3:1][N:2]1[CH2:3][CH2:4][N:5]([c:8]2[cH:9][c:10]([N+:20]([O-:21])=[O:22])[c:11]([N:14]3[CH2:15][CH2:16][CH2:17][CH2:18][CH2:19]3)[cH:12][cH:13]2)[CH2:6][CH2:7]1.[CH:39]([N:40]([CH2:41][CH3:42])[CH:43]([CH3:44])[CH3:45])([CH3:46])[CH3:47].[Cl:33][C:34]([C:35]([Cl:36])=[O:37])=[O:38]>>[CH3:1][N:2]1[CH2:3][CH2:4][N:5]([c:8]2[cH:9][c:10]([NH:20][C:30]([c:28]3[cH:27][cH:26][c:25]([C:23]#[N:24])[o:29]3)=[O:31])[c:11]([N:14]3[CH2:15][CH2:16][CH2:17][CH2:18][CH2:19]3)[cH:12][cH:13]2)[CH2:6][CH2:7]1

Participants

5

Reactant 4

HCID 65578Oxalyl chlorideHCID 81531DiisopropylethylamineHCID 108555165-cyanofuran-2-carboxylic AcidHCID 586384911-Methyl4-(3-nitro-4-piperidin-1-yl-phenyl)-piperazine

Product 1

HCID 117038755-Cyano-furan-2-carboxylic acid [5-(4-methyl-piperazin-1-yl)-2-piperidin-1-yl-phenyl]-amide

Sources & evidence

ORD record
ord-fc789777a1f54d2da10a369fb2f0c1f4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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