Pyridine → acetic acid [4-(2,4-dioxo-4H-benzo[d][1,3]oxazin-1-ylmethyl)-pyridin-2-ylcarbamoyl]-methyl ester

HRID 1200360

반응식

[C:21]([CH3:22])(=[O:23])[O:24][CH2:25][C:26](=[O:27])[Cl:28].[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:29]1[cH:30][cH:31][n:32][cH:33][cH:34]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:26]([CH2:25][O:24][C:21]([CH3:22])=[O:23])=[O:27]

참가 물질

반응물 3

HCID 1049Pyridine

HCID 26297Acetoxyacetyl chloride

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

생성물 1

HCID 86615650acetic acid [4-(2,4-dioxo-4H-benzo[d][1,3]oxazin-1-ylmethyl)-pyridin-2-ylcarbamoyl]-methyl ester

출처 및 근거

ORD 기록: ord-2c9f4bcbf4ec4e368c86a1244d87b8ee
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D

연결된 노트

불러오는 중…