4-[8-fluoranyl-7-methoxy-4-oxidanylidene-3-(trifluoromethyl)-5H-isothiochromeno[4,3-c]pyrazol-1-yl]benzenesulfonamide

Systemtic Name: 4-[8-fluoranyl-7-methoxy-4-oxidanylidene-3-(trifluoromethyl)-5H-isothiochromeno[4,3-c]pyrazol-1-yl]benzenesulfonamide Openeye Name: 4-[8-fluoro-7-methoxy-4-oxo-3-(trifluoromethyl)-5H-isothiochromeno[4,3-c]pyrazol-1-yl]benzenesulfonamide CAS Name: 4-[8-fluoro-7-methoxy-4-oxo-3-(trifluoromethyl)-5H-isothiochromeno[4,3-c]pyrazol-1-yl]benzenesulfonamide IUPAC Name: 4-[8-fluoro-7-methoxy-4-oxo-3-(trifluoromethyl)-5H-isothiochromeno[4,3-c]pyrazol-1-yl]benzenesulfonamide Traditional Name: 4-[8-fluoro-4-keto-7-methoxy-3-(trifluoromethyl)-5H-isothiochromeno[4,3-c]pyrazol-1-yl]benzenesulfonamide Formula: C18H13F4N3O4S2 MolecularWeight: 475.437133

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CS(=O)C3=C2N(N=C3C(F)(F)F)C4=CC=C(C=C4)S(=O)(=O)N)F

Isomeric SMILES

COC1=C(C=C2C(=C1)CS(=O)C3=C2N(N=C3C(F)(F)F)C4=CC=C(C=C4)S(=O)(=O)N)F

InChI

InChI=1S/C18H13F4N3O4S2/c1-29-14-6-9-8-30(26)16-15(12(9)7-13(14)19)25(24-17(16)18(20,21)22)10-2-4-11(5-3-10)31(23,27)28/h2-7H,8H2,1H3,(H2,23,27,28)