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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 70942Generated: October 25, 2026

4-(Trifluoromethyl)benzenecarbothioyl chloride → N-[2-(4-Chloro-2H-benzotriazol-2-yl)-1-cyano-1-methylethyl]-4-trifluoromethylthiobenzamide

https://huagongshe.com/reaction/70942

Reaction equation

Participants

RoleNameHCIDCharge
Reactant4-(Trifluoromethyl)benzenecarbothioyl chlorideHCID 19862484—
Reactant2-amino-3-(4-chloro-2H-benzotriazol-2-yl)-2-methylpropionitrileHCID 66620057—
ProductN-[2-(4-Chloro-2H-benzotriazol-2-yl)-1-cyano-1-methylethyl]-4-trifluoromethylthiobenzamideHCID 86625558—

Reaction Steps

Using a procedure similar to that described in Example 1, except using 2-amino-3-(4-chloro-2H-benzotriazol-2-yl)-2-methylpropionitrile (100 mg, described in Example 35) and 4-trifluoromethylthiobenzoyl chloride (0.1 mL), the title compound was isolated as a white solid (130 mg, 70%). Rf=0.6 (1:1 EA/heptane). MS (ES): M/Z [M+H]=440. NMR: (400 MHz, DMSO-d6): 1.75 (s, 3H), 5.43 (d, J=13.3 Hz, 1H), 5.55 (d, J=13.4 Hz, 1H), 7.46 (t, J=8.0 Hz, 1H), 7.59 (d, J=6.7 Hz, 1H), 7.75-7.95 (m, 5H) and 8.97 (s, 1H). 19F NMR (376 MHz, DMSO-d6): −41.98 (s, 3F).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08822689B2
Source datasetuspto-grants-2014_09
ORD IDord-8b8d4e2c49ff46df87e8dfa63c42a497
Source noteuspto-grants-2014_09