Aniline → 2-aminopyrido[2,3-d]pyrimidin-7(8H)-one 39

반응식

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

참가 물질

반응물 2

HCID 6115Aniline

HCID 105969946-(2,6-dichlorophenyl)-8-ethyl-2-methanesulfonyl-8H-pyrido[2,3-d]pyrimidin-7-one

생성물 1

HCID 53278862-aminopyrido[2,3-d]pyrimidin-7(8H)-one 39

출처 및 근거

ORD 기록: ord-014a6d03dc454efea2da06f8fe4c04dc
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

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