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

Systemtic Name: 3-[3-(4-methylsulfonylphenyl)-5-(trifluoromethyl)-1H-pyrazol-4-yl]pyridine Openeye Name: 3-[3-(4-methylsulfonylphenyl)-5-(trifluoromethyl)-1H-pyrazol-4-yl]pyridine CAS Name: 3-[3-(4-methylsulfonylphenyl)-5-(trifluoromethyl)-1H-pyrazol-4-yl]pyridine IUPAC Name: 3-[3-(4-methylsulfonylphenyl)-5-(trifluoromethyl)-1H-pyrazol-4-yl]pyridine Traditional Name: 3-[3-(4-mesylphenyl)-5-(trifluoromethyl)-1H-pyrazol-4-yl]pyridine Formula: C16H12F3N3O2S MolecularWeight: 367.34559

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=NNC(=C2C3=CN=CC=C3)C(F)(F)F

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=NNC(=C2C3=CN=CC=C3)C(F)(F)F

InChI

InChI=1S/C16H12F3N3O2S/c1-25(23,24)12-6-4-10(5-7-12)14-13(11-3-2-8-20-9-11)15(22-21-14)16(17,18)19/h2-9H,1H3,(H,21,22)