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llms.txt · MCP 가이드개인정보처리방침 · 이용약관 · 지원v1.8.0
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Water → methyl 8-(1-(3,5-difluorophenylamino)ethyl)-2-(ethylthio)-4-oxo-4H-chromene-6-carboxylate

HRID 1568941
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HRID 1568941 반응식
[Br:1][c:2]1[cH:3][c:4]([C:16](=[O:17])[O:18][CH3:19])[cH:5][c:6]2[c:7](=[O:15])[cH:8][c:9]([S:12][CH2:13][CH3:14])[o:10][c:11]12.[C:29]([CH3:30])([O:31][CH2:32][CH3:33])=[O:34].[F:20][c:21]1[cH:22][c:23]([NH2:24])[cH:25][c:26]([F:28])[cH:27]1.[OH2:35]>>[c:2]1([CH:29]([NH:24][c:23]2[cH:22][c:21]([F:20])[cH:27][c:26]([F:28])[cH:25]2)[CH3:30])[cH:3][c:4]([C:16](=[O:17])[O:18][CH3:19])[cH:5][c:6]2[c:7](=[O:15])[cH:8][c:9]([S:12][CH2:13][CH3:14])[o:10][c:11]12
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5

반응물 4

HCID 962WaterHCID 8857Ethyl AcetateHCID 965953,5-DifluoroanilineHCID 58235026methyl 8-bromo-2-(ethylthio)-4-oxo-4H-chromene-6-carboxylate

생성물 1

HCID 58235050methyl 8-(1-(3,5-difluorophenylamino)ethyl)-2-(ethylthio)-4-oxo-4H-chromene-6-carboxylate

출처 및 근거

ORD 기록
ord-8727ab4e6b3b41e3b6510dd7769914a0
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI
10.1039/C8SC04228D

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