Acetonitrile → (6-Chloro-2-methyl-5-nitro-pyrimidin-4-yl)(2,4,6-trimethyl-pyridin-3-yl)amine

반응식

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

참가 물질

반응물 3

HCID 6342Acetonitrile

HCID 831924,6-Dichloro-2-methyl-5-nitropyrimidine

HCID 988462,4,6-Trimethyl-3-pyridinamine

생성물 1

HCID 10757155(6-Chloro-2-methyl-5-nitro-pyrimidin-4-yl)(2,4,6-trimethyl-pyridin-3-yl)amine

출처 및 근거

ORD 기록: ord-c5fb59104afa4468bb2a8ad0875ee5a8
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

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