Tetrahydrofuran → 4-[5-Amino-2-(4-cyanoanilino)pyrimidin-4-yl]oxy-3,5-dimethyl-benzonitrile

반응식

[C:1](#[N:2])[c:3]1[cH:4][c:5]([CH3:29])[c:6]([O:7][c:8]2[n:9][c:10]([NH:17][c:18]3[cH:19][cH:20][c:21]([C:22]#[N:23])[cH:24][cH:25]3)[n:11][cH:12][c:13]2[N+:14]([O-:15])=[O:16])[c:26]([CH3:28])[cH:27]1.[O:30]1[CH2:31][CH2:32][CH2:33][CH2:34]1>>[C:1](#[N:2])[c:3]1[cH:4][c:5]([CH3:29])[c:6]([O:7][c:8]2[n:9][c:10]([NH:17][c:18]3[cH:19][cH:20][c:21]([C:22]#[N:23])[cH:24][cH:25]3)[n:11][cH:12][c:13]2[NH2:14])[c:26]([CH3:28])[cH:27]1

참가 물질

반응물 2

HCID 8028Tetrahydrofuran

HCID 4863944-[[4-(4-Cyano-2,6-dimethylphenoxy)-5-nitro-2-pyrimidinyl]amino]benzonitrile

생성물 1

HCID 4863954-[5-Amino-2-(4-cyanoanilino)pyrimidin-4-yl]oxy-3,5-dimethyl-benzonitrile

출처 및 근거

ORD 기록: ord-325ffdc65d854cc59ae19c7e41f5e13e
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D

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