N-[(6-fluoranyl-4H-1,3-benzodioxin-8-yl)methyl]-4-(phenylsulfonyl)thiophene-2-sulfonamide

Systemtic Name: N-[(6-fluoranyl-4H-1,3-benzodioxin-8-yl)methyl]-4-(phenylsulfonyl)thiophene-2-sulfonamide Openeye Name: 4-(benzenesulfonyl)-N-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methyl]thiophene-2-sulfonamide CAS Name: 4-(benzenesulfonyl)-N-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methyl]-2-thiophenesulfonamide IUPAC Name: 4-(benzenesulfonyl)-N-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methyl]thiophene-2-sulfonamide Traditional Name: 4-besyl-N-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methyl]thiophene-2-sulfonamide Formula: C19H16FNO6S3 MolecularWeight: 469.526843

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=CC(=C2OCO1)CNS(=O)(=O)C3=CC(=CS3)S(=O)(=O)C4=CC=CC=C4)F

Isomeric SMILES

C1C2=CC(=CC(=C2OCO1)CNS(=O)(=O)C3=CC(=CS3)S(=O)(=O)C4=CC=CC=C4)F

InChI

InChI=1S/C19H16FNO6S3/c20-15-6-13(19-14(7-15)10-26-12-27-19)9-21-30(24,25)18-8-17(11-28-18)29(22,23)16-4-2-1-3-5-16/h1-8,11,21H,9-10,12H2