N-(2-fluoranyl-5-methylsulfonyl-phenyl)-4-morpholin-4-ylsulfonyl-benzenesulfonamide

Systemtic Name: N-(2-fluoranyl-5-methylsulfonyl-phenyl)-4-morpholin-4-ylsulfonyl-benzenesulfonamide Openeye Name: N-(2-fluoro-5-methylsulfonyl-phenyl)-4-morpholinosulfonyl-benzenesulfonamide CAS Name: N-(2-fluoro-5-methylsulfonylphenyl)-4-(4-morpholinylsulfonyl)benzenesulfonamide IUPAC Name: N-(2-fluoro-5-methylsulfonylphenyl)-4-morpholin-4-ylsulfonylbenzenesulfonamide Traditional Name: N-(2-fluoro-5-mesyl-phenyl)-4-morpholinosulfonyl-benzenesulfonamide Formula: C17H19FN2O7S3 MolecularWeight: 478.535363

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)F)NS(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)F)NS(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C17H19FN2O7S3/c1-28(21,22)15-6-7-16(18)17(12-15)19-29(23,24)13-2-4-14(5-3-13)30(25,26)20-8-10-27-11-9-20/h2-7,12,19H,8-11H2,1H3