7-methyl-1-(4-methylsulfonylphenyl)-3-(trifluoromethyl)-5H-isochromeno[4,3-c]pyrazole

Systemtic Name: 7-methyl-1-(4-methylsulfonylphenyl)-3-(trifluoromethyl)-5H-isochromeno[4,3-c]pyrazole Openeye Name: 7-methyl-1-(4-methylsulfonylphenyl)-3-(trifluoromethyl)-5H-isochromeno[4,3-c]pyrazole CAS Name: 7-methyl-1-(4-methylsulfonylphenyl)-3-(trifluoromethyl)-5H-[2]benzopyrano[4,3-c]pyrazole IUPAC Name: 7-methyl-1-(4-methylsulfonylphenyl)-3-(trifluoromethyl)-5H-isochromeno[4,3-c]pyrazole Traditional Name: 1-(4-mesylphenyl)-7-methyl-3-(trifluoromethyl)-5H-isochromeno[4,3-c]pyrazole Formula: C19H15F3N2O3S MolecularWeight: 408.39421

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C3=C(C(=NN3C4=CC=C(C=C4)S(=O)(=O)C)C(F)(F)F)OC2

Isomeric SMILES

CC1=CC2=C(C=C1)C3=C(C(=NN3C4=CC=C(C=C4)S(=O)(=O)C)C(F)(F)F)OC2

InChI

InChI=1S/C19H15F3N2O3S/c1-11-3-8-15-12(9-11)10-27-17-16(15)24(23-18(17)19(20,21)22)13-4-6-14(7-5-13)28(2,25)26/h3-9H,10H2,1-2H3