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Acetic Acid → 2-[3-(4-Phenoxy-phenyl)-ureido]-thiophene-3-carboxylic acid tert-butyl ester

HRID 89231
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HRID 89231 반응식
[CH3:31][C:32](=[O:33])[OH:34].[NH2:1][c:2]1[s:3][cH:4][cH:5][c:6]1[C:7](=[O:8])[O:9][C:10]([CH3:11])([CH3:12])[CH3:13].[O:14]([c:15]1[cH:16][cH:17][cH:18][cH:19][cH:20]1)[c:21]1[cH:22][cH:23][c:24]([N:27]=[C:28]=[O:29])[cH:25][cH:26]1.[OH2:30].[cH:35]1[cH:36][cH:37][n:38][cH:39][cH:40]1>>[NH:1]([c:2]1[s:3][cH:4][cH:5][c:6]1[C:7](=[O:8])[O:9][C:10]([CH3:11])([CH3:12])[CH3:13])[C:28]([NH:27][c:24]1[cH:23][cH:22][c:21]([O:14][c:15]2[cH:16][cH:17][cH:18][cH:19][cH:20]2)[cH:26][cH:25]1)=[O:29]
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반응물 5

HCID 176Acetic AcidHCID 962WaterHCID 1049PyridineHCID 27348964-Phenoxyphenyl isocyanateHCID 10845692Tert-butyl 2-aminothiophene-3-carboxylate

생성물 1

HCID 866265972-[3-(4-Phenoxy-phenyl)-ureido]-thiophene-3-carboxylic acid tert-butyl ester

출처 및 근거

ORD 기록
ord-9059f3e35e6c42a0bd988dc018ad2aec
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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