2-fluoranyl-N-[4-[[2-methoxy-4-[2,2,2-tris(fluoranyl)ethoxy]phenyl]carbamothioylamino]phenyl]benzamide

Systemtic Name: 2-fluoranyl-N-[4-[[2-methoxy-4-[2,2,2-tris(fluoranyl)ethoxy]phenyl]carbamothioylamino]phenyl]benzamide Openeye Name: 2-fluoro-N-[4-[[2-methoxy-4-(2,2,2-trifluoroethoxy)phenyl]carbamothioylamino]phenyl]benzamide CAS Name: 2-fluoro-N-[4-[[[2-methoxy-4-(2,2,2-trifluoroethoxy)anilino]-sulfanylidenemethyl]amino]phenyl]benzamide IUPAC Name: 2-fluoro-N-[4-[[2-methoxy-4-(2,2,2-trifluoroethoxy)phenyl]carbamothioylamino]phenyl]benzamide Traditional Name: 2-fluoro-N-[4-[[2-methoxy-4-(2,2,2-trifluoroethoxy)phenyl]thiocarbamoylamino]phenyl]benzamide Formula: C23H19F4N3O3S MolecularWeight: 493.473873

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)OCC(F)(F)F)NC(=S)NC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3F

Isomeric SMILES

COC1=C(C=CC(=C1)OCC(F)(F)F)NC(=S)NC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3F

InChI

InChI=1S/C23H19F4N3O3S/c1-32-20-12-16(33-13-23(25,26)27)10-11-19(20)30-22(34)29-15-8-6-14(7-9-15)28-21(31)17-4-2-3-5-18(17)24/h2-12H,13H2,1H3,(H,28,31)(H2,29,30,34)