N-[2-(3,4-dimethylphenyl)sulfonyl-2-pyridin-3-yl-ethyl]-2-fluoranyl-5-methyl-benzenesulfonamide

Systemtic Name: N-[2-(3,4-dimethylphenyl)sulfonyl-2-pyridin-3-yl-ethyl]-2-fluoranyl-5-methyl-benzenesulfonamide Openeye Name: N-[2-(3,4-dimethylphenyl)sulfonyl-2-(3-pyridyl)ethyl]-2-fluoro-5-methyl-benzenesulfonamide CAS Name: N-[2-(3,4-dimethylphenyl)sulfonyl-2-(3-pyridinyl)ethyl]-2-fluoro-5-methylbenzenesulfonamide IUPAC Name: N-[2-(3,4-dimethylphenyl)sulfonyl-2-pyridin-3-ylethyl]-2-fluoro-5-methylbenzenesulfonamide Traditional Name: N-[2-(3,4-dimethylphenyl)sulfonyl-2-(3-pyridyl)ethyl]-2-fluoro-5-methyl-benzenesulfonamide Formula: C22H23FN2O4S2 MolecularWeight: 462.557423

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)F)S(=O)(=O)NCC(C2=CN=CC=C2)S(=O)(=O)C3=CC(=C(C=C3)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)F)S(=O)(=O)NCC(C2=CN=CC=C2)S(=O)(=O)C3=CC(=C(C=C3)C)C

InChI

InChI=1S/C22H23FN2O4S2/c1-15-6-9-20(23)21(11-15)31(28,29)25-14-22(18-5-4-10-24-13-18)30(26,27)19-8-7-16(2)17(3)12-19/h4-13,22,25H,14H2,1-3H3