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Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
HRID 573907생성일: 2026년 10월 26일

1-(4-Fluoro-2-isopropylphenyl)thiourea → 1-[(4-Fluoro-2-isopropyl-phenyl)carbamothioyl]-3-[2-[3-[1-[4-(trifluoromethoxy)phenyl]-1,2,4-triazol-3-yl]phenyl]ethyl]urea

https://huagongshe.com/reaction/573907

반응식

참여 물질

역할이름HCID투입량
반응물1-(4-Fluoro-2-isopropylphenyl)thioureaHCID 89373245—
반응물3-(3-(2-isocyanatoethyl)phenyl)-1-(4-(trifluoromethoxy)phenyl)-1H-1,2,4-triazoleHCID 90404747—
생성물1-[(4-Fluoro-2-isopropyl-phenyl)carbamothioyl]-3-[2-[3-[1-[4-(trifluoromethoxy)phenyl]-1,2,4-triazol-3-yl]phenyl]ethyl]ureaHCID 90404410—

반응 단계

The title compound was prepared as described in Example 75 using 3-(3-(2-isocyanatoethyl)phenyl)-1-(4-(trifluoromethoxy)phenyl)-1H-1,2,4-triazole (CA44) and 1-(4-fluoro-2-isopropylphenyl)thiourea isolated as a white solid (0.085 g, 27%): 1H NMR (400 MHz, DMSO-d6) δ 11.83 (s, 1H), 10.17 (s, 1H), 9.42 (s, 1H), 8.14-8.05 (m, 2H), 8.05-7.95 (m, 2H), 7.68-7.58 (m, 2H), 7.49 (t, J=7.6 Hz, 1H), 7.43-7.31 (m, 2H), 7.15 (dd, J=10.3, 3.0 Hz, 1H), 7.03 (td, J=8.3, 2.9 Hz, 2H), 3.47 (q, J=6.6 Hz, 2H), 3.01-2.82 (m, 3H), 1.14 (d, J=6.8 Hz, 6H); 19F NMR (376 MHz, DMSO-d6) δ −56.97, −114.40; ESIMS m/z 587 ([M+H]+), 585 ([M−H]−).

출처 및 근거

DOI10.6084/m9.figshare.5104873.v1
특허 번호US09029560B2
출처 데이터셋uspto-grants-2015_05
ORD IDord-e16bd3a5c346437a8ceeff096e96bd0d
출처 메모uspto-grants-2015_05