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

Systemtic Name: N-[(2S)-2-(4-fluoranyl-3-methyl-phenyl)sulfonyl-2-pyridin-3-yl-ethyl]-3,4-dimethoxy-benzenesulfonamide Openeye Name: N-[(2S)-2-(4-fluoro-3-methyl-phenyl)sulfonyl-2-(3-pyridyl)ethyl]-3,4-dimethoxy-benzenesulfonamide CAS Name: N-[(2S)-2-(4-fluoro-3-methylphenyl)sulfonyl-2-(3-pyridinyl)ethyl]-3,4-dimethoxybenzenesulfonamide IUPAC Name: N-[(2S)-2-(4-fluoro-3-methylphenyl)sulfonyl-2-pyridin-3-ylethyl]-3,4-dimethoxybenzenesulfonamide Traditional Name: N-[(2S)-2-(4-fluoro-3-methyl-phenyl)sulfonyl-2-(3-pyridyl)ethyl]-3,4-dimethoxy-benzenesulfonamide Formula: C22H23FN2O6S2 MolecularWeight: 494.556223

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)[C@H](CNS(=O)(=O)C2=CC(=C(C=C2)OC)OC)C3=CN=CC=C3)F

InChI

InChI=1S/C22H23FN2O6S2/c1-15-11-17(6-8-19(15)23)32(26,27)22(16-5-4-10-24-13-16)14-25-33(28,29)18-7-9-20(30-2)21(12-18)31-3/h4-13,22,25H,14H2,1-3H3/t22-/m1/s1