Pyridine → {3-[4-(2,4-Dioxo-4H-benzo[d][1,3]oxazin-1-ylmethyl)-pyridin-2-yl]-ureido}-acetic acid ethyl ester

HRID 701290

반응식

[CH2:21]([CH3:22])[O:23][C:24]([CH2:25][N:26]=[C:27]=[O:28])=[O:29].[NH2:1][c:2]1[n:3][cH:4][cH:5][c:6]([CH2:8][n:9]2[c:10](=[O:20])[o:11][c:12](=[O:19])[c:13]3[c:14]2[cH:15][cH:16][cH:17][cH:18]3)[cH:7]1.[cH:30]1[cH:31][cH:32][n:33][cH:34][cH:35]1>>[NH:1]([c:2]1[n:3][cH:4][cH:5][c:6]([CH2:8][n:9]2[c:10](=[O:20])[o:11][c:12](=[O:19])[c:13]3[c:14]2[cH:15][cH:16][cH:17][cH:18]3)[cH:7]1)[C:27]([NH:26][CH2:25][C:24]([O:23][CH2:21][CH3:22])=[O:29])=[O:28]

참가 물질

반응물 3

HCID 1049Pyridine

HCID 76283Ethyl isocyanatoacetate

HCID 583773961-(2-Amino-pyridin-4-ylmethyl)-1H-benzo[d][1,3]oxazine-2,4-dione

생성물 1

HCID 86615648{3-[4-(2,4-Dioxo-4H-benzo[d][1,3]oxazin-1-ylmethyl)-pyridin-2-yl]-ureido}-acetic acid ethyl ester

출처 및 근거

ORD 기록: ord-708757bdc0ec4d529aeedefb3dc10f91
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D

연결된 노트

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