6-(4-fluorophenyl)-3-[2-(4-fluorophenyl)-2-oxidanylidene-ethyl]sulfanyl-1H-[1,2,4]triazolo[4,3-b][1,2,4]triazin-7-one

Systemtic Name: 6-(4-fluorophenyl)-3-[2-(4-fluorophenyl)-2-oxidanylidene-ethyl]sulfanyl-1H-[1,2,4]triazolo[4,3-b][1,2,4]triazin-7-one Openeye Name: 6-(4-fluorophenyl)-3-[2-(4-fluorophenyl)-2-oxo-ethyl]sulfanyl-1H-[1,2,4]triazolo[4,3-b][1,2,4]triazin-7-one CAS Name: 6-(4-fluorophenyl)-3-[[2-(4-fluorophenyl)-2-oxoethyl]thio]-1H-[1,2,4]triazolo[4,3-b][1,2,4]triazin-7-one IUPAC Name: 6-(4-fluorophenyl)-3-[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl-1H-[1,2,4]triazolo[4,3-b][1,2,4]triazin-7-one Traditional Name: 6-(4-fluorophenyl)-3-[[2-(4-fluorophenyl)-2-keto-ethyl]thio]-1H-[1,2,4]triazolo[4,3-b][1,2,4]triazin-7-one Formula: C18H11F2N5O2S MolecularWeight: 399.374046

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NN3C(=NC2=O)NN=C3SCC(=O)C4=CC=C(C=C4)F)F

Isomeric SMILES

C1=CC(=CC=C1C2=NN3C(=NC2=O)NN=C3SCC(=O)C4=CC=C(C=C4)F)F

InChI

InChI=1S/C18H11F2N5O2S/c19-12-5-1-10(2-6-12)14(26)9-28-18-23-22-17-21-16(27)15(24-25(17)18)11-3-7-13(20)8-4-11/h1-8H,9H2,(H,21,22,27)