2-(5-Methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)acetic acid → N-{2-[5-(4-Chloro-2-nitrophenyl)-1,3,4-thiadiazole-2-sulfonylamino]-ethyl}-N-[(thymin-1-yl)-acetyl]-glycine Ethyl Ester

HRID 110214

반응식

HRID 110214 반응식
[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][NH:6][CH2:7][CH2:8][NH:9][S:10](=[O:11])(=[O:12])[c:13]1[s:14][c:15](-[c:18]2[c:19]([N+:25](=[O:26])[O-:27])[cH:20][c:21]([Cl:24])[cH:22][cH:23]2)[n:16][n:17]1)=[O:28].[n:29]1([CH2:38][C:39](=[O:40])[OH:41])[c:30](=[O:31])[nH:32][c:33](=[O:34])[c:35]([CH3:36])[cH:37]1>>[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][N:6]([CH2:7][CH2:8][NH:9][S:10](=[O:11])(=[O:12])[c:13]1[s:14][c:15](-[c:18]2[c:19]([N+:25](=[O:26])[O-:27])[cH:20][c:21]([Cl:24])[cH:22][cH:23]2)[n:16][n:17]1)[C:39]([CH2:38][n:29]1[c:30](=[O:31])[nH:32][c:33](=[O:34])[c:35]([CH3:36])[cH:37]1)=[O:40])=[O:28]

참가 물질

3

반응물 2

HCID 8537532-(5-Methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)acetic acidHCID 21092774N-{2-[5-(4-chloro-2-nitrophenyl)-1,3,4-thiadiazole-2-sulfonylamino]-ethyl}-glycine ethyl ester

생성물 1

HCID 21092794N-{2-[5-(4-Chloro-2-nitrophenyl)-1,3,4-thiadiazole-2-sulfonylamino]-ethyl}-N-[(thymin-1-yl)-acetyl]-glycine Ethyl Ester

출처 및 근거

ORD 기록
ord-df25eb933e7a4ba2a2620189dd83c70e
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

연결된 노트

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