N-(2-fluoranyl-5-methylsulfonyl-phenyl)-4-pyrrolidin-1-ylsulfonyl-benzenesulfonamide

Systemtic Name: N-(2-fluoranyl-5-methylsulfonyl-phenyl)-4-pyrrolidin-1-ylsulfonyl-benzenesulfonamide Openeye Name: N-(2-fluoro-5-methylsulfonyl-phenyl)-4-pyrrolidin-1-ylsulfonyl-benzenesulfonamide CAS Name: N-(2-fluoro-5-methylsulfonylphenyl)-4-(1-pyrrolidinylsulfonyl)benzenesulfonamide IUPAC Name: N-(2-fluoro-5-methylsulfonylphenyl)-4-pyrrolidin-1-ylsulfonylbenzenesulfonamide Traditional Name: N-(2-fluoro-5-mesyl-phenyl)-4-pyrrolidinosulfonyl-benzenesulfonamide Formula: C17H19FN2O6S3 MolecularWeight: 462.535963

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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)N3CCCC3

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)F)NS(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C17H19FN2O6S3/c1-27(21,22)15-8-9-16(18)17(12-15)19-28(23,24)13-4-6-14(7-5-13)29(25,26)20-10-2-3-11-20/h4-9,12,19H,2-3,10-11H2,1H3