Water → Methyl 6-[(1-amino-4-methyl-1-oxopentan-2-yl)amino]-4-cyano-2-(1-methylpyrazol-4-yl)pyridine-3-carboxylate

Reaktionsgleichung

[Cl:1][c:2]1[n:3][c:4](-[c:14]2[cH:15][n:16][n:17]([CH3:19])[cH:18]2)[c:5]([C:6](=[O:7])[O:8][CH3:9])[c:10]([C:12]#[N:13])[cH:11]1.[NH2:20][CH:21]([C:22](=[O:23])[NH2:24])[CH2:25][CH:26]([CH3:27])[CH3:28].[OH2:29]>>[c:2]1([NH:20][CH:21]([C:22](=[O:23])[NH2:24])[CH2:25][CH:26]([CH3:27])[CH3:28])[n:3][c:4](-[c:14]2[cH:15][n:16][n:17]([CH3:19])[cH:18]2)[c:5]([C:6](=[O:7])[O:8][CH3:9])[c:10]([C:12]#[N:13])[cH:11]1

Komponenten

Edukt 3

HCID 962Water

HCID 114616Pentanamide, 2-amino-4-methyl-

HCID 58317582methyl 6-chloro-4-cyano-2-(1-methyl-1H-pyrazol-4-yl)nicotinate

Produkt 1

HCID 67237474Methyl 6-[(1-amino-4-methyl-1-oxopentan-2-yl)amino]-4-cyano-2-(1-methylpyrazol-4-yl)pyridine-3-carboxylate

Quellen und Nachweise

ORD-Eintrag: ord-668c7a4f1d8e4778b94b4670689be9bb
Quelldatensatz: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

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