6-fluoranyl-7-methoxy-1-(4-sulfinamoyloxyphenyl)-3-(trifluoromethyl)-5H-isothiochromeno[4,3-c]pyrazole

Systemtic Name: 6-fluoranyl-7-methoxy-1-(4-sulfinamoyloxyphenyl)-3-(trifluoromethyl)-5H-isothiochromeno[4,3-c]pyrazole Openeye Name: 6-fluoro-7-methoxy-1-(4-sulfinamoyloxyphenyl)-3-(trifluoromethyl)-5H-isothiochromeno[4,3-c]pyrazole CAS Name: 6-fluoro-7-methoxy-1-(4-sulfinamoyloxyphenyl)-3-(trifluoromethyl)-5H-isothiochromeno[4,3-c]pyrazole IUPAC Name: 6-fluoro-7-methoxy-1-(4-sulfinamoyloxyphenyl)-3-(trifluoromethyl)-5H-isothiochromeno[4,3-c]pyrazole Traditional Name: 6-fluoro-7-methoxy-1-(4-sulfinamoyloxyphenyl)-3-(trifluoromethyl)-5H-isothiochromeno[4,3-c]pyrazole Formula: C18H13F4N3O3S2 MolecularWeight: 459.437733

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)C3=C(C(=NN3C4=CC=C(C=C4)OS(=O)N)C(F)(F)F)SC2)F

Isomeric SMILES

COC1=C(C2=C(C=C1)C3=C(C(=NN3C4=CC=C(C=C4)OS(=O)N)C(F)(F)F)SC2)F

InChI

InChI=1S/C18H13F4N3O3S2/c1-27-13-7-6-11-12(14(13)19)8-29-16-15(11)25(24-17(16)18(20,21)22)9-2-4-10(5-3-9)28-30(23)26/h2-7H,8,23H2,1H3