2,6-Xylyl isocyanate → 1-[6-(3-Chloro-phenylamino)-pyrimidin-4-yl]-3-(2,6-dimethyl-phenyl)-urea

Reaktionsgleichung

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

Komponenten

Edukt 2

HCID 987872,6-Xylyl isocyanate

HCID 66669982N~4~-(3-chlorophenyl)pyrimidine-4,6-diamine

Produkt 1

HCID 577102711-[6-(3-Chloro-phenylamino)-pyrimidin-4-yl]-3-(2,6-dimethyl-phenyl)-urea

Quellen und Nachweise

ORD-Eintrag: ord-944e6d783e0c46078592641bd7ee0dfa
Quelldatensatz: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

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