4-[[5-cyano-4-oxidanylidene-6-(5-thiophen-2-ylthiophen-2-yl)-1H-pyrimidin-2-yl]sulfanylmethyl]-N-(4-fluorophenyl)benzenesulfonamide

Systemtic Name: 4-[[5-cyano-4-oxidanylidene-6-(5-thiophen-2-ylthiophen-2-yl)-1H-pyrimidin-2-yl]sulfanylmethyl]-N-(4-fluorophenyl)benzenesulfonamide Openeye Name: 4-[[5-cyano-4-oxo-6-[5-(2-thienyl)-2-thienyl]-1H-pyrimidin-2-yl]sulfanylmethyl]-N-(4-fluorophenyl)benzenesulfonamide CAS Name: 4-[[[5-cyano-4-oxo-6-(5-thiophen-2-yl-2-thiophenyl)-1H-pyrimidin-2-yl]thio]methyl]-N-(4-fluorophenyl)benzenesulfonamide IUPAC Name: 4-[[5-cyano-4-oxo-6-(5-thiophen-2-ylthiophen-2-yl)-1H-pyrimidin-2-yl]sulfanylmethyl]-N-(4-fluorophenyl)benzenesulfonamide Traditional Name: 4-[[[5-cyano-4-keto-6-[5-(2-thienyl)-2-thienyl]-1H-pyrimidin-2-yl]thio]methyl]-N-(4-fluorophenyl)benzenesulfonamide Formula: C26H17FN4O3S4 MolecularWeight: 580.696583

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=CC=C(S2)C3=C(C(=O)N=C(N3)SCC4=CC=C(C=C4)S(=O)(=O)NC5=CC=C(C=C5)F)C#N

Isomeric SMILES

C1=CSC(=C1)C2=CC=C(S2)C3=C(C(=O)N=C(N3)SCC4=CC=C(C=C4)S(=O)(=O)NC5=CC=C(C=C5)F)C#N

InChI

InChI=1S/C26H17FN4O3S4/c27-17-5-7-18(8-6-17)31-38(33,34)19-9-3-16(4-10-19)15-36-26-29-24(20(14-28)25(32)30-26)23-12-11-22(37-23)21-2-1-13-35-21/h1-13,31H,15H2,(H,29,30,32)