1,1,1-tris(fluoranyl)-N-[2-(quinolin-2-ylmethylsulfanyl)phenyl]methanesulfonamide

Systemtic Name: 1,1,1-tris(fluoranyl)-N-[2-(quinolin-2-ylmethylsulfanyl)phenyl]methanesulfonamide Openeye Name: 1,1,1-trifluoro-N-[2-(2-quinolylmethylsulfanyl)phenyl]methanesulfonamide CAS Name: 1,1,1-trifluoro-N-[2-(2-quinolinylmethylthio)phenyl]methanesulfonamide IUPAC Name: 1,1,1-trifluoro-N-[2-(quinolin-2-ylmethylsulfanyl)phenyl]methanesulfonamide Traditional Name: 1,1,1-trifluoro-N-[2-(2-quinolylmethylthio)phenyl]methanesulfonamide Formula: C17H13F3N2O2S2 MolecularWeight: 398.42253

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)CSC3=CC=CC=C3NS(=O)(=O)C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)CSC3=CC=CC=C3NS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C17H13F3N2O2S2/c18-17(19,20)26(23,24)22-15-7-3-4-8-16(15)25-11-13-10-9-12-5-1-2-6-14(12)21-13/h1-10,22H,11H2