1-Amino-5-isopropylamino-pentan-3-ol → 3-(4-Chloro-2,6-difluoro-benzyloxy)-5-[3-(3-hydroxy-5-isopropylamino-pentyl)-ureido]-isothiazole-4-carboxylic Acid Amide

HRID 812328

반응식

HRID 812328 반응식
[NH2:30][CH2:31][CH2:32][CH:33]([CH2:34][CH2:35][NH:36][CH:37]([CH3:38])[CH3:39])[OH:40].[c:1]1([O:2][C:8]([NH:9][c:10]2[c:11]([C:26]([NH2:27])=[O:28])[c:12]([O:15][CH2:16][c:17]3[c:18]([F:25])[cH:19][c:20]([Cl:24])[cH:21][c:22]3[F:23])[n:13][s:14]2)=[O:29])[cH:3][cH:4][cH:5][cH:6][cH:7]1>>[C:8]([NH:9][c:10]1[c:11]([C:26]([NH2:27])=[O:28])[c:12]([O:15][CH2:16][c:17]2[c:18]([F:25])[cH:19][c:20]([Cl:24])[cH:21][c:22]2[F:23])[n:13][s:14]1)(=[O:29])[NH:30][CH2:31][CH2:32][CH:33]([CH2:34][CH2:35][NH:36][CH:37]([CH3:38])[CH3:39])[OH:40]

참가 물질

3

반응물 2

HCID 185507511-Amino-5-isopropylamino-pentan-3-olHCID 54007095[4-Carbamoyl-3-(2,6-difluoro-4-chloro-benzyloxy)-isothiazol-5-yl]carbamic acid phenyl ester

생성물 1

HCID 685066243-(4-Chloro-2,6-difluoro-benzyloxy)-5-[3-(3-hydroxy-5-isopropylamino-pentyl)-ureido]-isothiazole-4-carboxylic Acid Amide

출처 및 근거

ORD 기록
ord-2bc7eaa925a34e28b9799f7e160e2fbc
출처 데이터셋
Test data from https://doi.org/10.1039/C8SC04228D

연결된 노트

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