4-[6-fluoranyl-7-methyl-3-(trifluoromethyl)-5H-isothiochromeno[4,3-c]pyrazol-1-yl]benzenesulfonamide

Systemtic Name: 4-[6-fluoranyl-7-methyl-3-(trifluoromethyl)-5H-isothiochromeno[4,3-c]pyrazol-1-yl]benzenesulfonamide Openeye Name: 4-[6-fluoro-7-methyl-3-(trifluoromethyl)-5H-isothiochromeno[4,3-c]pyrazol-1-yl]benzenesulfonamide CAS Name: 4-[6-fluoro-7-methyl-3-(trifluoromethyl)-5H-isothiochromeno[4,3-c]pyrazol-1-yl]benzenesulfonamide IUPAC Name: 4-[6-fluoro-7-methyl-3-(trifluoromethyl)-5H-isothiochromeno[4,3-c]pyrazol-1-yl]benzenesulfonamide Traditional Name: 4-[6-fluoro-7-methyl-3-(trifluoromethyl)-5H-isothiochromeno[4,3-c]pyrazol-1-yl]benzenesulfonamide Formula: C18H13F4N3O2S2 MolecularWeight: 443.438333

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C3=C(C(=NN3C4=CC=C(C=C4)S(=O)(=O)N)C(F)(F)F)SC2)F

Isomeric SMILES

CC1=C(C2=C(C=C1)C3=C(C(=NN3C4=CC=C(C=C4)S(=O)(=O)N)C(F)(F)F)SC2)F

InChI

InChI=1S/C18H13F4N3O2S2/c1-9-2-7-12-13(14(9)19)8-28-16-15(12)25(24-17(16)18(20,21)22)10-3-5-11(6-4-10)29(23,26)27/h2-7H,8H2,1H3,(H2,23,26,27)