4-[2,2,2-tris(fluoranyl)ethoxy]quinoline-3-carbothioamide

Systemtic Name: 4-[2,2,2-tris(fluoranyl)ethoxy]quinoline-3-carbothioamide Openeye Name: 4-(2,2,2-trifluoroethoxy)quinoline-3-carbothioamide CAS Name: 4-(2,2,2-trifluoroethoxy)-3-quinolinecarbothioamide IUPAC Name: 4-(2,2,2-trifluoroethoxy)quinoline-3-carbothioamide Traditional Name: 4-(2,2,2-trifluoroethoxy)quinoline-3-carbothioamide Formula: C12H9F3N2OS MolecularWeight: 286.27287

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(C=N2)C(=S)N)OCC(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(C=N2)C(=S)N)OCC(F)(F)F

InChI

InChI=1S/C12H9F3N2OS/c13-12(14,15)6-18-10-7-3-1-2-4-9(7)17-5-8(10)11(16)19/h1-5H,6H2,(H2,16,19)