4-fluoranyl-N-[[4-[(4-fluorophenyl)carbonylcarbamothioylamino]phenyl]carbamothioyl]benzamide

Systemtic Name: 4-fluoranyl-N-[[4-[(4-fluorophenyl)carbonylcarbamothioylamino]phenyl]carbamothioyl]benzamide Openeye Name: 4-fluoro-N-[[4-[(4-fluorobenzoyl)carbamothioylamino]phenyl]carbamothioyl]benzamide CAS Name: 4-fluoro-N-[[4-[[[[(4-fluorophenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-fluoro-N-[[4-[(4-fluorobenzoyl)carbamothioylamino]phenyl]carbamothioyl]benzamide Traditional Name: 4-fluoro-N-[[4-[(4-fluorobenzoyl)thiocarbamoylamino]phenyl]thiocarbamoyl]benzamide Formula: C22H16F2N4O2S2 MolecularWeight: 470.514846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NC(=S)NC2=CC=C(C=C2)NC(=S)NC(=O)C3=CC=C(C=C3)F)F

Isomeric SMILES

C1=CC(=CC=C1C(=O)NC(=S)NC2=CC=C(C=C2)NC(=S)NC(=O)C3=CC=C(C=C3)F)F

InChI

InChI=1S/C22H16F2N4O2S2/c23-15-5-1-13(2-6-15)19(29)27-21(31)25-17-9-11-18(12-10-17)26-22(32)28-20(30)14-3-7-16(24)8-4-14/h1-12H,(H2,25,27,29,31)(H2,26,28,30,32)