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

Systemtic Name: 4-(4-chlorophenyl)-2-[4-(4-fluorophenyl)-4-oxidanylidene-butyl]sulfanyl-6-thiophen-2-yl-pyridine-3-carbonitrile Openeye Name: 4-(4-chlorophenyl)-2-[4-(4-fluorophenyl)-4-oxo-butyl]sulfanyl-6-(2-thienyl)pyridine-3-carbonitrile CAS Name: 4-(4-chlorophenyl)-2-[[4-(4-fluorophenyl)-4-oxobutyl]thio]-6-thiophen-2-yl-3-pyridinecarbonitrile IUPAC Name: 4-(4-chlorophenyl)-2-[4-(4-fluorophenyl)-4-oxobutyl]sulfanyl-6-thiophen-2-ylpyridine-3-carbonitrile Traditional Name: 4-(4-chlorophenyl)-2-[[4-(4-fluorophenyl)-4-keto-butyl]thio]-6-(2-thienyl)nicotinonitrile Formula: C26H18ClFN2OS2 MolecularWeight: 493.015323

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=NC(=C(C(=C2)C3=CC=C(C=C3)Cl)C#N)SCCCC(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1=CSC(=C1)C2=NC(=C(C(=C2)C3=CC=C(C=C3)Cl)C#N)SCCCC(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C26H18ClFN2OS2/c27-19-9-5-17(6-10-19)21-15-23(25-4-2-13-32-25)30-26(22(21)16-29)33-14-1-3-24(31)18-7-11-20(28)12-8-18/h2,4-13,15H,1,3,14H2