2-(4-methylsulfonylphenyl)-3-[4-(trifluoromethyl)phenyl]-4,5-dihydroindazole

Systemtic Name: 2-(4-methylsulfonylphenyl)-3-[4-(trifluoromethyl)phenyl]-4,5-dihydroindazole Openeye Name: 2-(4-methylsulfonylphenyl)-3-[4-(trifluoromethyl)phenyl]-4,5-dihydroindazole CAS Name: 2-(4-methylsulfonylphenyl)-3-[4-(trifluoromethyl)phenyl]-4,5-dihydroindazole IUPAC Name: 2-(4-methylsulfonylphenyl)-3-[4-(trifluoromethyl)phenyl]-4,5-dihydroindazole Traditional Name: 2-(4-mesylphenyl)-3-[4-(trifluoromethyl)phenyl]-4,5-dihydroindazole Formula: C21H17F3N2O2S MolecularWeight: 418.43209

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)N2C(=C3CCC=CC3=N2)C4=CC=C(C=C4)C(F)(F)F

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)N2C(=C3CCC=CC3=N2)C4=CC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C21H17F3N2O2S/c1-29(27,28)17-12-10-16(11-13-17)26-20(18-4-2-3-5-19(18)25-26)14-6-8-15(9-7-14)21(22,23)24/h3,5-13H,2,4H2,1H3