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Water → 5-(4-Hydroxy-phenylsulfanyl)-4-nitro-thiophene-2-carboxylic acid (3-bromo-phenyl)-amide

HRID 320491
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인쇄 미리보기

반응식

HRID 320491 반응식
[Br:31][c:32]1[cH:33][c:34]([NH2:35])[cH:36][cH:37][cH:38]1.[CH3:26][N:27]([CH3:28])[CH:29]=[O:30].[CH3:42][CH2:43][O:44][C:45](=[O:46])[CH3:47].[Cl:20][C:21]([C:22]([Cl:23])=[O:24])=[O:25].[Cl:39][CH2:40][Cl:41].[OH2:48].[OH:1][c:2]1[cH:3][cH:4][c:5]([S:8][c:9]2[c:10]([N+:17](=[O:18])[O-:19])[cH:11][c:12]([C:14](=[O:15])[OH:16])[s:13]2)[cH:6][cH:7]1.[cH:49]1[cH:50][cH:51][n:52][cH:53][cH:54]1>>[OH:1][c:2]1[cH:3][cH:4][c:5]([S:8][c:9]2[c:10]([N+:17](=[O:18])[O-:19])[cH:11][c:12]([C:14](=[O:16])[NH:35][c:34]3[cH:33][c:32]([Br:31])[cH:38][cH:37][cH:36]3)[s:13]2)[cH:6][cH:7]1
참가 물질출처 및 근거반응 노트

참가 물질

9

반응물 8

HCID 962WaterHCID 1049PyridineHCID 6228DimethylformamideHCID 6344DichloromethaneHCID 8857Ethyl AcetateHCID 115623-BromoanilineHCID 65578Oxalyl chloride
HCID 67040639
5-(4-Hydroxy-phenylsulfanyl)-4-nitro-thiophene-2-carboxylic acid

생성물 1

HCID 670409995-(4-Hydroxy-phenylsulfanyl)-4-nitro-thiophene-2-carboxylic acid (3-bromo-phenyl)-amide

출처 및 근거

ORD 기록
ord-afb10d704c0a4e25b2d0739bde2bc349
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI
10.1039/C8SC04228D

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