N-[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-2-pyridin-3-yl-ethyl]-4-fluoranyl-3-methyl-benzenesulfonamide

Systemtic Name: N-[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-2-pyridin-3-yl-ethyl]-4-fluoranyl-3-methyl-benzenesulfonamide Openeye Name: N-[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-2-(3-pyridyl)ethyl]-4-fluoro-3-methyl-benzenesulfonamide CAS Name: N-[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-2-(3-pyridinyl)ethyl]-4-fluoro-3-methylbenzenesulfonamide IUPAC Name: N-[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-2-pyridin-3-ylethyl]-4-fluoro-3-methylbenzenesulfonamide Traditional Name: N-[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-2-(3-pyridyl)ethyl]-4-fluoro-3-methyl-benzenesulfonamide Formula: C22H21FN2O6S2 MolecularWeight: 492.540343

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)NCC(C2=CN=CC=C2)S(=O)(=O)C3=CC4=C(C=C3)OCCO4)F

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)NCC(C2=CN=CC=C2)S(=O)(=O)C3=CC4=C(C=C3)OCCO4)F

InChI

InChI=1S/C22H21FN2O6S2/c1-15-11-18(4-6-19(15)23)33(28,29)25-14-22(16-3-2-8-24-13-16)32(26,27)17-5-7-20-21(12-17)31-10-9-30-20/h2-8,11-13,22,25H,9-10,14H2,1H3