3-(2-phenylethanoylcarbamothioylamino)-N-[3-(trifluoromethyl)phenyl]benzamide

Systemtic Name: 3-(2-phenylethanoylcarbamothioylamino)-N-[3-(trifluoromethyl)phenyl]benzamide Openeye Name: 3-[(2-phenylacetyl)carbamothioylamino]-N-[3-(trifluoromethyl)phenyl]benzamide CAS Name: 3-[[[(1-oxo-2-phenylethyl)amino]-sulfanylidenemethyl]amino]-N-[3-(trifluoromethyl)phenyl]benzamide IUPAC Name: 3-[(2-phenylacetyl)carbamothioylamino]-N-[3-(trifluoromethyl)phenyl]benzamide Traditional Name: 3-[(2-phenylacetyl)thiocarbamoylamino]-N-[3-(trifluoromethyl)phenyl]benzamide Formula: C23H18F3N3O2S MolecularWeight: 457.46813

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NC3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)CC(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NC3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C23H18F3N3O2S/c24-23(25,26)17-9-5-11-19(14-17)27-21(31)16-8-4-10-18(13-16)28-22(32)29-20(30)12-15-6-2-1-3-7-15/h1-11,13-14H,12H2,(H,27,31)(H2,28,29,30,32)