5-Ethyl-6-(3,5-dimethylphenoxy)-2,4-pyrimidinedione → 1-(Cyclobutylmethyl)-6-(3,5-dimethylphenoxy)-5-ethyl-pyrimidine-2,4-dione

HRID 171656

반응식

HRID 171656 반응식
[CH2:1]([CH3:2])[c:3]1[c:4](=[O:19])[nH:5][c:6](=[O:18])[nH:7][c:8]1[O:9][c:10]1[cH:11][c:12]([CH3:17])[cH:13][c:14]([CH3:16])[cH:15]1.[c:20]1([CH3:21])[cH:22][cH:23][c:24]([S:25]([O:26][CH2:30][CH:31]2[CH2:32][CH2:33][CH2:34]2)(=[O:27])=[O:28])[cH:29][cH:35]1>>[CH2:1]([CH3:2])[c:3]1[c:4](=[O:19])[nH:5][c:6](=[O:18])[n:7]([CH2:30][CH:31]2[CH2:32][CH2:33][CH2:34]2)[c:8]1[O:9][c:10]1[cH:11][c:12]([CH3:17])[cH:13][c:14]([CH3:16])[cH:15]1

참가 물질

3

반응물 2

HCID 109232665-Ethyl-6-(3,5-dimethylphenoxy)-2,4-pyrimidinedioneHCID 13163931Cyclobutylmethyl 4-methylbenzenesulfonate

생성물 1

HCID 99493421-(Cyclobutylmethyl)-6-(3,5-dimethylphenoxy)-5-ethyl-pyrimidine-2,4-dione

출처 및 근거

ORD 기록
ord-3d30c4a051834e459ac3b33486df2696
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

연결된 노트

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