2-[4-(4-fluorophenyl)-4-oxidanylidene-butyl]sulfanyl-6-thiophen-2-yl-4-(trifluoromethyl)pyridine-3-carbonitrile

Systemtic Name: 2-[4-(4-fluorophenyl)-4-oxidanylidene-butyl]sulfanyl-6-thiophen-2-yl-4-(trifluoromethyl)pyridine-3-carbonitrile Openeye Name: 2-[4-(4-fluorophenyl)-4-oxo-butyl]sulfanyl-6-(2-thienyl)-4-(trifluoromethyl)pyridine-3-carbonitrile CAS Name: 2-[[4-(4-fluorophenyl)-4-oxobutyl]thio]-6-thiophen-2-yl-4-(trifluoromethyl)-3-pyridinecarbonitrile IUPAC Name: 2-[4-(4-fluorophenyl)-4-oxobutyl]sulfanyl-6-thiophen-2-yl-4-(trifluoromethyl)pyridine-3-carbonitrile Traditional Name: 2-[[4-(4-fluorophenyl)-4-keto-butyl]thio]-6-(2-thienyl)-4-(trifluoromethyl)nicotinonitrile Formula: C21H14F4N2OS2 MolecularWeight: 450.472273

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=NC(=C(C(=C2)C(F)(F)F)C#N)SCCCC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

C1=CSC(=C1)C2=NC(=C(C(=C2)C(F)(F)F)C#N)SCCCC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H14F4N2OS2/c22-14-7-5-13(6-8-14)18(28)3-1-10-30-20-15(12-26)16(21(23,24)25)11-17(27-20)19-4-2-9-29-19/h2,4-9,11H,1,3,10H2