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

Systemtic Name: 4-fluoranyl-2-methyl-N-[2-(4-methylphenyl)sulfonyl-2-pyridin-3-yl-ethyl]benzenesulfonamide Openeye Name: 4-fluoro-2-methyl-N-[2-(p-tolylsulfonyl)-2-(3-pyridyl)ethyl]benzenesulfonamide CAS Name: 4-fluoro-2-methyl-N-[2-(4-methylphenyl)sulfonyl-2-(3-pyridinyl)ethyl]benzenesulfonamide IUPAC Name: 4-fluoro-2-methyl-N-[2-(4-methylphenyl)sulfonyl-2-pyridin-3-ylethyl]benzenesulfonamide Traditional Name: 4-fluoro-2-methyl-N-[2-(3-pyridyl)-2-tosyl-ethyl]benzenesulfonamide Formula: C21H21FN2O4S2 MolecularWeight: 448.530843

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21FN2O4S2/c1-15-5-8-19(9-6-15)29(25,26)21(17-4-3-11-23-13-17)14-24-30(27,28)20-10-7-18(22)12-16(20)2/h3-13,21,24H,14H2,1-2H3