N-[4-[2-[2-fluoranyl-5-(trifluoromethyl)phenyl]sulfinylethylcarbamothioylamino]phenyl]-1,2,3-thiadiazole-4-carboxamide

Systemtic Name: N-[4-[2-[2-fluoranyl-5-(trifluoromethyl)phenyl]sulfinylethylcarbamothioylamino]phenyl]-1,2,3-thiadiazole-4-carboxamide Openeye Name: N-[4-[2-[2-fluoro-5-(trifluoromethyl)phenyl]sulfinylethylcarbamothioylamino]phenyl]thiadiazole-4-carboxamide CAS Name: N-[4-[[[2-[2-fluoro-5-(trifluoromethyl)phenyl]sulfinylethylamino]-sulfanylidenemethyl]amino]phenyl]-4-thiadiazolecarboxamide IUPAC Name: N-[4-[2-[2-fluoro-5-(trifluoromethyl)phenyl]sulfinylethylcarbamothioylamino]phenyl]thiadiazole-4-carboxamide Traditional Name: N-[4-[2-[2-fluoro-5-(trifluoromethyl)phenyl]sulfinylethylthiocarbamoylamino]phenyl]thiadiazole-4-carboxamide Formula: C19H15F4N5O2S3 MolecularWeight: 517.543313

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)C2=CSN=N2)NC(=S)NCCS(=O)C3=C(C=CC(=C3)C(F)(F)F)F

Isomeric SMILES

C1=CC(=CC=C1NC(=O)C2=CSN=N2)NC(=S)NCCS(=O)C3=C(C=CC(=C3)C(F)(F)F)F

InChI

InChI=1S/C19H15F4N5O2S3/c20-14-6-1-11(19(21,22)23)9-16(14)33(30)8-7-24-18(31)26-13-4-2-12(3-5-13)25-17(29)15-10-32-28-27-15/h1-6,9-10H,7-8H2,(H,25,29)(H2,24,26,31)