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Hydrochloric Acid → N-[1-[3,5-difluoro-4-(methanesulfonamido)phenyl]propyl]-3-[2-ethoxy-4-(trifluoromethyl)phenyl]prop-2-enamide

HRID 810423
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HRID 810423 반응식
[CH2:1]([CH3:2])[O:3][c:4]1[c:5]([CH:14]=[CH:15][C:16](=[O:17])[OH:18])[cH:6][cH:7][c:8]([C:10]([F:11])([F:12])[F:13])[cH:9]1.[CH3:37][N:38]1[CH2:39][CH2:40][O:41][CH2:42][CH2:43]1.[CH3:45][N:46]([CH3:47])[CH2:48][CH2:49][CH2:50][N:51]=[C:52]=[N:53][CH2:54][CH3:55].[CH3:61][CH2:62][O:63][C:64]([CH3:65])=[O:66].[ClH:36].[ClH:44].[NH2:19][CH:20]([CH2:21][CH3:22])[c:23]1[cH:24][c:25]([F:35])[c:26]([NH:30][S:31](=[O:32])(=[O:33])[CH3:34])[c:27]([F:29])[cH:28]1.[O:56]=[CH:57][N:58]([CH3:59])[CH3:60]>>[CH2:1]([CH3:2])[O:3][c:4]1[c:5]([CH:14]=[CH:15][C:16](=[O:18])[NH:19][CH:20]([CH2:21][CH3:22])[c:23]2[cH:24][c:25]([F:35])[c:26]([NH:30][S:31](=[O:32])(=[O:33])[CH3:34])[c:27]([F:29])[cH:28]2)[cH:6][cH:7][c:8]([C:10]([F:11])([F:12])[F:13])[cH:9]1
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 313Hydrochloric Acid2회HCID 6228DimethylformamideHCID 79724-MethylmorpholineHCID 8857Ethyl AcetateHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 66855369N-[4-(1-aminopropyl)-2,6-difluorophenyl]methanesulfonamide
HCID 66856730
3-(2-Ethoxy-4-trifluoromethyl-phenyl)-acrylic acid

생성물 1

HCID 66855838N-[1-[3,5-difluoro-4-(methanesulfonamido)phenyl]propyl]-3-[2-ethoxy-4-(trifluoromethyl)phenyl]prop-2-enamide

출처 및 근거

ORD 기록
ord-ad4c0d80840b4f01abdea83c1cdaa8a7
출처 데이터셋
Test data from https://doi.org/10.1039/C8SC04228D
DOI
10.1039/C8SC04228D

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