4-[6-fluoranyl-3-(trifluoromethyl)-5H-isothiochromeno[4,3-c]pyrazol-1-yl]benzenesulfonamide

Systemtic Name: 4-[6-fluoranyl-3-(trifluoromethyl)-5H-isothiochromeno[4,3-c]pyrazol-1-yl]benzenesulfonamide Openeye Name: 4-[6-fluoro-3-(trifluoromethyl)-5H-isothiochromeno[4,3-c]pyrazol-1-yl]benzenesulfonamide CAS Name: 4-[6-fluoro-3-(trifluoromethyl)-5H-isothiochromeno[4,3-c]pyrazol-1-yl]benzenesulfonamide IUPAC Name: 4-[6-fluoro-3-(trifluoromethyl)-5H-isothiochromeno[4,3-c]pyrazol-1-yl]benzenesulfonamide Traditional Name: 4-[6-fluoro-3-(trifluoromethyl)-5H-isothiochromeno[4,3-c]pyrazol-1-yl]benzenesulfonamide Formula: C17H11F4N3O2S2 MolecularWeight: 429.411753

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=CC=C2F)C3=C(S1)C(=NN3C4=CC=C(C=C4)S(=O)(=O)N)C(F)(F)F

Isomeric SMILES

C1C2=C(C=CC=C2F)C3=C(S1)C(=NN3C4=CC=C(C=C4)S(=O)(=O)N)C(F)(F)F

InChI

InChI=1S/C17H11F4N3O2S2/c18-13-3-1-2-11-12(13)8-27-15-14(11)24(23-16(15)17(19,20)21)9-4-6-10(7-5-9)28(22,25)26/h1-7H,8H2,(H2,22,25,26)