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Ethylene Glycol → ethyl 3-{2-chloro-5-[1-methyl-1-(4-trifluoromethyl-6H-pyrazolo[4',3':3,4]benzo[1,2-d]thiazol-2-ylcarbamoyl)-ethylamino]-benzoylamino}-propionate

HRID 829319
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인쇄 미리보기

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HRID 829319 반응식
[Br:1][C:2]([C:3](=[O:4])[NH:5][c:6]1[s:7][c:8]2[c:9]([n:10]1)[c:11]([C:18]([F:19])([F:20])[F:21])[cH:12][c:13]1[c:14]2[cH:15][n:16][nH:17]1)([CH3:22])[CH3:23].[NH2:24][c:25]1[cH:26][cH:27][c:28]([Cl:41])[c:29]([C:30](=[O:31])[NH:32][CH2:33][CH2:34][C:35](=[O:36])[O:37][CH2:38][CH3:39])[cH:40]1.[OH2:42].[OH:43][CH2:44][CH2:45][OH:46]>>[C:2]([C:3](=[O:4])[NH:5][c:6]1[s:7][c:8]2[c:9]([n:10]1)[c:11]([C:18]([F:19])([F:20])[F:21])[cH:12][c:13]1[c:14]2[cH:15][n:16][nH:17]1)([CH3:22])([CH3:23])[NH:24][c:25]1[cH:26][cH:27][c:28]([Cl:41])[c:29]([C:30](=[O:31])[NH:32][CH2:33][CH2:34][C:35](=[O:36])[O:37][CH2:38][CH3:39])[cH:40]1
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참가 물질

5

반응물 4

HCID 174Ethylene GlycolHCID 962WaterHCID 57421781HCID 57421781, 화합물HCID 579513762-bromo-2-methyl-N-(4-trifluoromethyl-6H-pyrazolo[4',3':3,4]benzo[1,2-d]thiazol-2-yl)-propionamide

생성물 1

HCID 57951397ethyl 3-{2-chloro-5-[1-methyl-1-(4-trifluoromethyl-6H-pyrazolo[4',3':3,4]benzo[1,2-d]thiazol-2-ylcarbamoyl)-ethylamino]-benzoylamino}-propionate

출처 및 근거

ORD 기록
ord-b645fa1ab2524931b324709d5b3c5f2a
출처 데이터셋
Test data from https://doi.org/10.1039/C8SC04228D
DOI
10.1039/C8SC04228D

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