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HRID 514178作成日:2026年10月25日

Water → N-benzyl-2-(4-(1-(4-(trifluoromethoxy)phenyl)-1H-1,2,4-triazol-3-yl)benzylidene)hydrazinecarbothioamide

https://huagongshe.com/reaction/514178

反応式

関与物質

役割名称HCID仕込み量
反応物WaterHCID 962—
反応物3-Amino-1-benzylthioureaHCID 737135—
反応物4-(1-(4-(trifluoromethoxy)phenyl)-1H-1,2,4-triazol-3-yl)benzaldehydeHCID 57824462—
溶媒EthanolHCID 702—
生成物N-benzyl-2-(4-(1-(4-(trifluoromethoxy)phenyl)-1H-1,2,4-triazol-3-yl)benzylidene)hydrazinecarbothioamideHCID 86667406—

反応条件

温度80 °C

反応手順

To a 50 mL round-bottomed flask containing 4-[1-[4-(trifluoromethoxy)phenyl]-1,2,4-triazol-3-yl]benzaldehyde (500 mg, 1.5 mmol) in EtOH (3 mL) was added 4-benzylthiosemicarbazide (650 mg, 3.6 mmol). The reaction mixture was heated at 80° C. overnight. H2O was added upon completion of the reaction, and the crude product material was isolated by vacuum filtration. The title compound was isolated via RP-HPLC as a white solid (390 mg, 52%): mp 220-224° C.; 1H NMR (400 MHz, CDCl3) δ 9.29 (s, 1H), 8.59 (s, 1H), 8.21 (d, J=8.4 Hz, 2H), 7.85-7.79 (m, 3H), 7.71 (d, J=8.4 Hz, 2H), 7.46-7.30 (m, 8H), 5.01 (d, J=5.8 Hz, 2H); ESIMS m/z 497.2 (M+H).

情報源と証拠

DOI10.6084/m9.figshare.5104873.v1
特許番号US09107413B2
出典データセットuspto-grants-2015_08
ORD IDord-64593f3e57834c1d86d9283c50f35b40
出典メモuspto-grants-2015_08