N-[4-[[3-fluoranyl-5-(trifluoromethyl)phenyl]methylcarbamothioylamino]phenyl]furan-2-carboxamide

Systemtic Name: N-[4-[[3-fluoranyl-5-(trifluoromethyl)phenyl]methylcarbamothioylamino]phenyl]furan-2-carboxamide Openeye Name: N-[4-[[3-fluoro-5-(trifluoromethyl)phenyl]methylcarbamothioylamino]phenyl]furan-2-carboxamide CAS Name: N-[4-[[[[3-fluoro-5-(trifluoromethyl)phenyl]methylamino]-sulfanylidenemethyl]amino]phenyl]-2-furancarboxamide IUPAC Name: N-[4-[[3-fluoro-5-(trifluoromethyl)phenyl]methylcarbamothioylamino]phenyl]furan-2-carboxamide Traditional Name: N-[4-[[3-fluoro-5-(trifluoromethyl)benzyl]thiocarbamoylamino]phenyl]-2-furamide Formula: C20H15F4N3O2S MolecularWeight: 437.410613

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C(=O)NC2=CC=C(C=C2)NC(=S)NCC3=CC(=CC(=C3)F)C(F)(F)F

Isomeric SMILES

C1=COC(=C1)C(=O)NC2=CC=C(C=C2)NC(=S)NCC3=CC(=CC(=C3)F)C(F)(F)F

InChI

InChI=1S/C20H15F4N3O2S/c21-14-9-12(8-13(10-14)20(22,23)24)11-25-19(30)27-16-5-3-15(4-6-16)26-18(28)17-2-1-7-29-17/h1-10H,11H2,(H,26,28)(H2,25,27,30)