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

Systemtic Name: 3-(3-phenylpropanoylcarbamothioylamino)-N-[3-(trifluoromethyl)phenyl]benzamide Openeye Name: 3-(3-phenylpropanoylcarbamothioylamino)-N-[3-(trifluoromethyl)phenyl]benzamide CAS Name: 3-[[[(1-oxo-3-phenylpropyl)amino]-sulfanylidenemethyl]amino]-N-[3-(trifluoromethyl)phenyl]benzamide IUPAC Name: 3-(3-phenylpropanoylcarbamothioylamino)-N-[3-(trifluoromethyl)phenyl]benzamide Traditional Name: 3-(hydrocinnamoylthiocarbamoylamino)-N-[3-(trifluoromethyl)phenyl]benzamide Formula: C24H20F3N3O2S MolecularWeight: 471.49471

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H20F3N3O2S/c25-24(26,27)18-9-5-11-20(15-18)28-22(32)17-8-4-10-19(14-17)29-23(33)30-21(31)13-12-16-6-2-1-3-7-16/h1-11,14-15H,12-13H2,(H,28,32)(H2,29,30,31,33)