4-[3-(4-methylsulfonylphenyl)-1-phenyl-5-(trifluoromethyl)pyrazol-4-yl]pyridine

Systemtic Name: 4-[3-(4-methylsulfonylphenyl)-1-phenyl-5-(trifluoromethyl)pyrazol-4-yl]pyridine Openeye Name: 4-[3-(4-methylsulfonylphenyl)-1-phenyl-5-(trifluoromethyl)pyrazol-4-yl]pyridine CAS Name: 4-[3-(4-methylsulfonylphenyl)-1-phenyl-5-(trifluoromethyl)-4-pyrazolyl]pyridine IUPAC Name: 4-[3-(4-methylsulfonylphenyl)-1-phenyl-5-(trifluoromethyl)pyrazol-4-yl]pyridine Traditional Name: 4-[3-(4-mesylphenyl)-1-phenyl-5-(trifluoromethyl)pyrazol-4-yl]pyridine Formula: C22H16F3N3O2S MolecularWeight: 443.44155

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=NN(C(=C2C3=CC=NC=C3)C(F)(F)F)C4=CC=CC=C4

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=NN(C(=C2C3=CC=NC=C3)C(F)(F)F)C4=CC=CC=C4

InChI

InChI=1S/C22H16F3N3O2S/c1-31(29,30)18-9-7-16(8-10-18)20-19(15-11-13-26-14-12-15)21(22(23,24)25)28(27-20)17-5-3-2-4-6-17/h2-14H,1H3