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llms.txt · MCP 가이드개인정보처리방침 · 이용약관 · 지원v1.8.0
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Hydrochloric Acid → N-[4-[(2,5-dioxoimidazolidin-1-yl)methyl]phenyl]-8-methyl-9-oxo-5,6-dihydrothiepino[4,5-f][1,3]benzodioxole-6-carboxamide

HRID 106843
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인쇄 미리보기

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HRID 106843 반응식
[CH2:1]1[O:2][c:3]2[cH:4][c:5]3[c:6]([cH:17][c:18]2[O:19]1)[CH2:7][CH:8]([C:14](=[O:15])[OH:16])[S:9][CH:10]([CH3:13])[C:11]3=[O:12].[CH2:36]([N:37]=[C:38]=[N:39][CH2:40][CH2:41][CH2:42][N:43]([CH3:44])[CH3:45])[CH3:46].[CH:52]([Cl:53])([Cl:54])[Cl:55].[ClH:35].[NH2:20][c:21]1[cH:22][cH:23][c:24]([CH2:25][N:26]2[C:27](=[O:32])[NH:28][CH2:29][C:30]2=[O:31])[cH:33][cH:34]1.[O:47]=[CH:48][N:49]([CH3:50])[CH3:51]>>[CH2:1]1[O:2][c:3]2[cH:4][c:5]3[c:6]([cH:17][c:18]2[O:19]1)[CH2:7][CH:8]([C:14](=[O:16])[NH:20][c:21]1[cH:22][cH:23][c:24]([CH2:25][N:26]2[C:27](=[O:32])[NH:28][CH2:29][C:30]2=[O:31])[cH:33][cH:34]1)[S:9][CH:10]([CH3:13])[C:11]3=[O:12]
참가 물질출처 및 근거반응 노트

참가 물질

7

반응물 6

HCID 313Hydrochloric AcidHCID 6212ChloroformHCID 6228DimethylformamideHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 106558433-[(4-Aminophenyl)methyl]imidazolidine-2,4-dioneHCID 159224451,2,4,5-Tetrahydro-4-methyl-7,8-methylenedioxy-5-oxo-3-benzothiepin-2-carboxylic acid

생성물 1

HCID 9804611
N-[4-[(2,5-dioxoimidazolidin-1-yl)methyl]phenyl]-8-methyl-9-oxo-5,6-dihydrothiepino[4,5-f][1,3]benzodioxole-6-carboxamide

출처 및 근거

ORD 기록
ord-f1e093a4583c46b79c6378fb26181c41
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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