3-(cyclohexylcarbonylcarbamothioylamino)-N-[3-(trifluoromethyl)phenyl]benzamide

Systemtic Name: 3-(cyclohexylcarbonylcarbamothioylamino)-N-[3-(trifluoromethyl)phenyl]benzamide Openeye Name: 3-(cyclohexanecarbonylcarbamothioylamino)-N-[3-(trifluoromethyl)phenyl]benzamide CAS Name: 3-[[[[cyclohexyl(oxo)methyl]amino]-sulfanylidenemethyl]amino]-N-[3-(trifluoromethyl)phenyl]benzamide IUPAC Name: 3-(cyclohexanecarbonylcarbamothioylamino)-N-[3-(trifluoromethyl)phenyl]benzamide Traditional Name: 3-(cyclohexanecarbonylthiocarbamoylamino)-N-[3-(trifluoromethyl)phenyl]benzamide Formula: C22H22F3N3O2S MolecularWeight: 449.48919

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NC3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

C1CCC(CC1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NC3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C22H22F3N3O2S/c23-22(24,25)16-9-5-11-18(13-16)26-20(30)15-8-4-10-17(12-15)27-21(31)28-19(29)14-6-2-1-3-7-14/h4-5,8-14H,1-3,6-7H2,(H,26,30)(H2,27,28,29,31)