2-fluoranyl-N-(3-methylbutyl)-5-methylsulfonyl-benzenesulfonamide

Systemtic Name: 2-fluoranyl-N-(3-methylbutyl)-5-methylsulfonyl-benzenesulfonamide Openeye Name: 2-fluoro-N-isopentyl-5-methylsulfonyl-benzenesulfonamide CAS Name: 2-fluoro-N-(3-methylbutyl)-5-methylsulfonylbenzenesulfonamide IUPAC Name: 2-fluoro-N-(3-methylbutyl)-5-methylsulfonylbenzenesulfonamide Traditional Name: 2-fluoro-N-isoamyl-5-mesyl-benzenesulfonamide Formula: C12H18FNO4S2 MolecularWeight: 323.404023

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNS(=O)(=O)C1=C(C=CC(=C1)S(=O)(=O)C)F

Isomeric SMILES

CC(C)CCNS(=O)(=O)C1=C(C=CC(=C1)S(=O)(=O)C)F

InChI

InChI=1S/C12H18FNO4S2/c1-9(2)6-7-14-20(17,18)12-8-10(19(3,15)16)4-5-11(12)13/h4-5,8-9,14H,6-7H2,1-3H3