Tetrahydrofuran → 1-(3-Fluoro-4-(3-nitropyridin-4-yloxy)phenyl)-3-(2-(4-fluorophenyl)acetyl)urea

반응식

[CH2:32]1[O:33][CH2:34][CH2:35][CH2:36]1.[F:19][c:20]1[cH:21][cH:22][c:23]([CH2:26][C:27](=[O:28])[N:29]=[C:30]=[O:31])[cH:24][cH:25]1.[F:1][c:2]1[cH:3][c:4]([NH2:18])[cH:5][cH:6][c:7]1[O:8][c:9]1[c:10]([N+:15](=[O:16])[O-:17])[cH:11][n:12][cH:13][cH:14]1>>[F:1][c:2]1[cH:3][c:4]([NH:18][C:30]([NH:29][C:27]([CH2:26][c:23]2[cH:22][cH:21][c:20]([F:19])[cH:25][cH:24]2)=[O:28])=[O:31])[cH:5][cH:6][c:7]1[O:8][c:9]1[c:10]([N+:15](=[O:16])[O-:17])[cH:11][n:12][cH:13][cH:14]1

참가 물질

반응물 3

HCID 8028Tetrahydrofuran

HCID 231530882-(4-Fluorophenyl)acetyl isocyanate

HCID 442030423-Fluoro-4-(3-nitropyridin-4-yloxy)benzenamine

생성물 1

HCID 598530011-(3-Fluoro-4-(3-nitropyridin-4-yloxy)phenyl)-3-(2-(4-fluorophenyl)acetyl)urea

출처 및 근거

ORD 기록: ord-254454ea5b34422a8599c0d15fc2693d
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D

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