N-[3-chloranyl-4-[[5-cyano-4-oxidanylidene-6-(5-thiophen-2-ylthiophen-2-yl)-1H-pyrimidin-2-yl]sulfanylmethyl]phenyl]-4-fluoranyl-benzenesulfonamide

Systemtic Name: N-[3-chloranyl-4-[[5-cyano-4-oxidanylidene-6-(5-thiophen-2-ylthiophen-2-yl)-1H-pyrimidin-2-yl]sulfanylmethyl]phenyl]-4-fluoranyl-benzenesulfonamide Openeye Name: N-[3-chloro-4-[[5-cyano-4-oxo-6-[5-(2-thienyl)-2-thienyl]-1H-pyrimidin-2-yl]sulfanylmethyl]phenyl]-4-fluoro-benzenesulfonamide CAS Name: N-[3-chloro-4-[[[5-cyano-4-oxo-6-(5-thiophen-2-yl-2-thiophenyl)-1H-pyrimidin-2-yl]thio]methyl]phenyl]-4-fluorobenzenesulfonamide IUPAC Name: N-[3-chloro-4-[[5-cyano-4-oxo-6-(5-thiophen-2-ylthiophen-2-yl)-1H-pyrimidin-2-yl]sulfanylmethyl]phenyl]-4-fluorobenzenesulfonamide Traditional Name: N-[3-chloro-4-[[[5-cyano-4-keto-6-[5-(2-thienyl)-2-thienyl]-1H-pyrimidin-2-yl]thio]methyl]phenyl]-4-fluoro-benzenesulfonamide Formula: C26H16ClFN4O3S4 MolecularWeight: 615.141643

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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=C(C=C(C=C4)NS(=O)(=O)C5=CC=C(C=C5)F)Cl)C#N

Isomeric SMILES

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

InChI

InChI=1S/C26H16ClFN4O3S4/c27-20-12-17(32-39(34,35)18-7-4-16(28)5-8-18)6-3-15(20)14-37-26-30-24(19(13-29)25(33)31-26)23-10-9-22(38-23)21-2-1-11-36-21/h1-12,32H,14H2,(H,30,31,33)