3-chloranyl-4-fluoranyl-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]benzenesulfonamide

Systemtic Name: 3-chloranyl-4-fluoranyl-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]benzenesulfonamide Openeye Name: 3-chloro-4-fluoro-N-[4-(3-pyridylmethylsulfanyl)phenyl]benzenesulfonamide CAS Name: 3-chloro-4-fluoro-N-[4-(3-pyridinylmethylthio)phenyl]benzenesulfonamide IUPAC Name: 3-chloro-4-fluoro-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]benzenesulfonamide Traditional Name: 3-chloro-4-fluoro-N-[4-(3-pyridylmethylthio)phenyl]benzenesulfonamide Formula: C18H14ClFN2O2S2 MolecularWeight: 408.897363

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CSC2=CC=C(C=C2)NS(=O)(=O)C3=CC(=C(C=C3)F)Cl

Isomeric SMILES

C1=CC(=CN=C1)CSC2=CC=C(C=C2)NS(=O)(=O)C3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C18H14ClFN2O2S2/c19-17-10-16(7-8-18(17)20)26(23,24)22-14-3-5-15(6-4-14)25-12-13-2-1-9-21-11-13/h1-11,22H,12H2