1,2-Dimethoxyethane → 2-Amino-4-[(benzo [1,3]dioxol-5-ylmethyl)-amino]-6-furan-2-yl-pyrimidine-5-carbonitrile

HRID 108062

반응식

HRID 108062 반응식
[CH2:18]([c:19]1[cH:20][c:21]2[c:25]([cH:26][cH:27]1)[O:24][CH2:23][O:22]2)[NH2:28].[CH3:29][O:30][CH2:31][CH2:32][O:33][CH3:34].[NH2:1][c:2]1[n:3][c:4]([S:15]([CH3:16])=[O:17])[c:5]([C:13]#[N:14])[c:6](-[c:8]2[o:9][cH:10][cH:11][cH:12]2)[n:7]1>>[NH2:1][c:2]1[n:3][c:4]([NH:28][CH2:18][c:19]2[cH:20][c:21]3[c:25]([cH:26][cH:27]2)[O:24][CH2:23][O:22]3)[c:5]([C:13]#[N:14])[c:6](-[c:8]2[o:9][cH:10][cH:11][cH:12]2)[n:7]1

참가 물질

4

반응물 3

HCID 80711,2-DimethoxyethaneHCID 75799Benzo-1,3-dioxole-5-methylamineHCID 185076922-Amino-4-(furan-2-YL)-6-(methylsulfinyl)pyrimidine-5-carbonitrile

생성물 1

HCID 99022562-Amino-4-[(benzo [1,3]dioxol-5-ylmethyl)-amino]-6-furan-2-yl-pyrimidine-5-carbonitrile

출처 및 근거

ORD 기록
ord-6e83eeb54c8246cd8483708873f59cc0
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

연결된 노트

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