Carbamic acid,[2-amino-4-chloro-5-[(2-methoxyethyl)methylamino]phenyl]-,1,1-dimethylethyl ester → (4-Chloro-5-[(2-methoxy-ethyl)-methyl-amino]-2-{3-[2-(3-methyl-isoxazol-5-yl)-pyridin-4-yl]-3-oxo-propionylamino}-phenyl)-carbamic acid tert.-butyl ester

HRID 101921

반응식

HRID 101921 반응식
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][c:8]1[c:9]([NH2:21])[cH:10][c:11]([Cl:20])[c:12]([N:14]([CH3:15])[CH2:16][CH2:17][O:18][CH3:19])[cH:13]1)=[O:22].[C:23]([CH3:25])([CH3:26])([O:27][C:28](=[O:24])[CH2:29][C:30](=[O:31])[c:32]1[cH:33][c:34](-[c:38]2[cH:39][c:40]([CH3:43])[n:41][o:42]2)[n:35][cH:36][cH:37]1)[CH3:44]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][c:8]1[c:9]([NH:21][C:28](=[O:27])[CH2:29][C:30](=[O:31])[c:32]2[cH:33][c:34](-[c:38]3[cH:39][c:40]([CH3:43])[n:41][o:42]3)[n:35][cH:36][cH:37]2)[cH:10][c:11]([Cl:20])[c:12]([N:14]([CH3:15])[CH2:16][CH2:17][O:18][CH3:19])[cH:13]1)=[O:22]

참가 물질

3

반응물 2

HCID 69687800Carbamic acid,[2-amino-4-chloro-5-[(2-methoxyethyl)methylamino]phenyl]-,1,1-dimethylethyl esterHCID 696881723-[2-(3-Methyl-isoxazol-5-yl)-pyridin-4-yl]-3-oxo-propionic acid tert.-butyl ester

생성물 1

HCID 86586809(4-Chloro-5-[(2-methoxy-ethyl)-methyl-amino]-2-{3-[2-(3-methyl-isoxazol-5-yl)-pyridin-4-yl]-3-oxo-propionylamino}-phenyl)-carbamic acid tert.-butyl ester

출처 및 근거

ORD 기록
ord-5ed5c6e3cb09445db75bac7591255e55
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

연결된 노트

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