2-bromanyl-N-[[3-[1,1,2,2-tetrakis(fluoranyl)-2-[1,1,2,2,3,3-hexakis(fluoranyl)-3-(trifluoromethyloxy)propoxy]ethyl]phenyl]carbamothioyl]benzamide

Systemtic Name: 2-bromanyl-N-[[3-[1,1,2,2-tetrakis(fluoranyl)-2-[1,1,2,2,3,3-hexakis(fluoranyl)-3-(trifluoromethyloxy)propoxy]ethyl]phenyl]carbamothioyl]benzamide Openeye Name: 2-bromo-N-[[3-[1,1,2,2-tetrafluoro-2-[1,1,2,2,3,3-hexafluoro-3-(trifluoromethoxy)propoxy]ethyl]phenyl]carbamothioyl]benzamide CAS Name: 2-bromo-N-[sulfanylidene-[3-[1,1,2,2-tetrafluoro-2-[1,1,2,2,3,3-hexafluoro-3-(trifluoromethoxy)propoxy]ethyl]anilino]methyl]benzamide IUPAC Name: 2-bromo-N-[[3-[1,1,2,2-tetrafluoro-2-[1,1,2,2,3,3-hexafluoro-3-(trifluoromethoxy)propoxy]ethyl]phenyl]carbamothioyl]benzamide Traditional Name: 2-bromo-N-[[3-[1,1,2,2-tetrafluoro-2-[1,1,2,2,3,3-hexafluoro-3-(trifluoromethoxy)propoxy]ethyl]phenyl]thiocarbamoyl]benzamide Formula: C20H10BrF13N2O3S MolecularWeight: 685.253242

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(C(OC(C(C(OC(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)Br

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(C(OC(C(C(OC(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)Br

InChI

InChI=1S/C20H10BrF13N2O3S/c21-12-7-2-1-6-11(12)13(37)36-14(40)35-10-5-3-4-9(8-10)15(22,23)17(26,27)38-18(28,29)16(24,25)19(30,31)39-20(32,33)34/h1-8H,(H2,35,36,37,40)