2-[2-(cyclohexen-1-yl)ethylcarbamothioyl]-N-[2-fluoranyl-6-(trifluoromethyl)phenyl]pyrazolidine-1-carboxamide

Systemtic Name: 2-[2-(cyclohexen-1-yl)ethylcarbamothioyl]-N-[2-fluoranyl-6-(trifluoromethyl)phenyl]pyrazolidine-1-carboxamide Openeye Name: 2-[2-(cyclohexen-1-yl)ethylcarbamothioyl]-N-[2-fluoro-6-(trifluoromethyl)phenyl]pyrazolidine-1-carboxamide CAS Name: 2-[[2-(1-cyclohexenyl)ethylamino]-sulfanylidenemethyl]-N-[2-fluoro-6-(trifluoromethyl)phenyl]-1-pyrazolidinecarboxamide IUPAC Name: 2-[2-(cyclohexen-1-yl)ethylcarbamothioyl]-N-[2-fluoro-6-(trifluoromethyl)phenyl]pyrazolidine-1-carboxamide Traditional Name: 2-[2-(cyclohexen-1-yl)ethylthiocarbamoyl]-N-[2-fluoro-6-(trifluoromethyl)phenyl]pyrazolidine-1-carboxamide Formula: C20H24F4N4OS MolecularWeight: 444.489373

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=CC1)CCNC(=S)N2CCCN2C(=O)NC3=C(C=CC=C3F)C(F)(F)F

Isomeric SMILES

C1CCC(=CC1)CCNC(=S)N2CCCN2C(=O)NC3=C(C=CC=C3F)C(F)(F)F

InChI

InChI=1S/C20H24F4N4OS/c21-16-9-4-8-15(20(22,23)24)17(16)26-18(29)27-12-5-13-28(27)19(30)25-11-10-14-6-2-1-3-7-14/h4,6,8-9H,1-3,5,7,10-13H2,(H,25,30)(H,26,29)