2-fluoranyl-6-[[(E)-2-(4-methyl-2-sulfanyl-phenyl)ethenyl]sulfonylamino]benzenesulfonamide

Systemtic Name: 2-fluoranyl-6-[[(E)-2-(4-methyl-2-sulfanyl-phenyl)ethenyl]sulfonylamino]benzenesulfonamide Openeye Name: 2-fluoro-6-[[(E)-2-(4-methyl-2-sulfanyl-phenyl)vinyl]sulfonylamino]benzenesulfonamide CAS Name: 2-fluoro-6-[[(E)-2-(2-mercapto-4-methylphenyl)ethenyl]sulfonylamino]benzenesulfonamide IUPAC Name: 2-fluoro-6-[[(E)-2-(4-methyl-2-sulfanylphenyl)ethenyl]sulfonylamino]benzenesulfonamide Traditional Name: 2-fluoro-6-[[(E)-2-(2-mercapto-4-methyl-phenyl)vinyl]sulfonylamino]benzenesulfonamide Formula: C15H15FN2O4S3 MolecularWeight: 402.484003

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C=CS(=O)(=O)NC2=C(C(=CC=C2)F)S(=O)(=O)N)S

Isomeric SMILES

CC1=CC(=C(C=C1)/C=C/S(=O)(=O)NC2=C(C(=CC=C2)F)S(=O)(=O)N)S

InChI

InChI=1S/C15H15FN2O4S3/c1-10-5-6-11(14(23)9-10)7-8-24(19,20)18-13-4-2-3-12(16)15(13)25(17,21)22/h2-9,18,23H,1H3,(H2,17,21,22)/b8-7+