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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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