2-chloranyl-N-[4-[2-cyano-5-(trifluoromethyl)pyridin-3-yl]sulfanylphenyl]benzenesulfonamide

Systemtic Name: 2-chloranyl-N-[4-[2-cyano-5-(trifluoromethyl)pyridin-3-yl]sulfanylphenyl]benzenesulfonamide Openeye Name: 2-chloro-N-[4-[[2-cyano-5-(trifluoromethyl)-3-pyridyl]sulfanyl]phenyl]benzenesulfonamide CAS Name: 2-chloro-N-[4-[[2-cyano-5-(trifluoromethyl)-3-pyridinyl]thio]phenyl]benzenesulfonamide IUPAC Name: 2-chloro-N-[4-[2-cyano-5-(trifluoromethyl)pyridin-3-yl]sulfanylphenyl]benzenesulfonamide Traditional Name: 2-chloro-N-[4-[[2-cyano-5-(trifluoromethyl)-3-pyridyl]thio]phenyl]benzenesulfonamide Formula: C19H11ClF3N3O2S2 MolecularWeight: 469.88775

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)S(=O)(=O)NC2=CC=C(C=C2)SC3=C(N=CC(=C3)C(F)(F)F)C#N)Cl

Isomeric SMILES

C1=CC=C(C(=C1)S(=O)(=O)NC2=CC=C(C=C2)SC3=C(N=CC(=C3)C(F)(F)F)C#N)Cl

InChI

InChI=1S/C19H11ClF3N3O2S2/c20-15-3-1-2-4-18(15)30(27,28)26-13-5-7-14(8-6-13)29-17-9-12(19(21,22)23)11-25-16(17)10-24/h1-9,11,26H