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

HRID 111154

반응식

HRID 111154 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[cH:19][cH:20][c:21]([N+:24](=[O:25])[O-:26])[cH:22][cH:23]2)[n:16][n:17]1)=[O:27].[n:28]1([CH2:37][C:38](=[O:39])[OH:40])[c:29](=[O:30])[nH:31][c:32](=[O:33])[c:34]([CH3:35])[cH:36]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[cH:19][cH:20][c:21]([N+:24](=[O:25])[O-:26])[cH:22][cH:23]2)[n:16][n:17]1)[C:38]([CH2:37][n:28]1[c:29](=[O:30])[nH:31][c:32](=[O:33])[c:34]([CH3:35])[cH:36]1)=[O:39])=[O:27]

참가 물질

3

반응물 2

HCID 8537532-(5-Methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)acetic acidHCID 21092799N-{2-[5-(4-nitrophenyl)-1,3,4-thiadiazole-2-sulfonylamino]-ethyl}-glycine ethyl ester

생성물 1

HCID 21092801N-{2-[5-(4-Nitrophenyl)-1,3,4-thiadiazole-2-sulfonylamino]-ethyl}-N-[(thymin-1-yl)-acetyl]-glycine Ethyl Ester

출처 및 근거

ORD 기록
ord-f1a4e5c3528f4d5dabd4091e7b51e2b1
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

연결된 노트

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